![CAS 189442-78-2 1-Boc-3-[methoxy(methyl)carbamoyl]piperidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/189442-78-2.gif)
CAS RN: 189442-78-2
1-Boc-3-[methoxy(methyl)carbamoyl]piperidine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250430 | 5g / 25g / 100g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-088574
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 0.25g, 5g
- Available purity: >97%
- Inventory rows with stock: 1
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
189442-78-2 / tert-butyl 3-[methoxy(methyl)carbamoyl]piperidine-1-carboxylate
Basic Information
CAS
189442-78-2
Multi CAS
No
Molecular Formula
C13H24N2O4
Molecular Weight
272.340000
Exact Mass
272.173607
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)C(=O)N(C)OC
InChI
InChI=1S/C13H24N2O4/c1-13(2,3)19-12(17)15-8-6-7-10(9-15)11(16)14(4)18-5/h10H,6-9H2,1-5H3
InChIKey
NQGXVXHYGRAABB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Fraction Csp3
0.85
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
70.31
TPSA
59.08
LogP / Solubility
WLOGP
1.65
MLOGP
1.46
XLogP3
1.1
Consensus LogP
1.4
Log S (ESOL)
-2.44
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.99
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.04
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.21
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2
Customers Also Viewed
-
Ethyl N-Boc-4-methylpiperidine-4-carboxylate
- CAS RN: 189442-87-3
- Product Code: SSC-088575
-
-
-
1-[4-(METHYLSULFANYL)PHENYL]-1,4-PENTANEDIONE
- CAS RN: 189501-33-5
- Product Code: SSC-088623
-
Ethyl 2-(8-hydroxy-1,4-dioxaspiro[4.5]decan-8-yl)acetate
- CAS RN: 189509-22-6
- Product Code: SSC-088633
-
ethyl 2-(tert-butoxycarbonylamino)thiazole-4-carboxylate
- CAS RN: 189512-01-4
- Product Code: SSC-088637
![CAS 189501-33-5 1-[4-(METHYLSULFANYL)PHENYL]-1,4-PENTANEDIONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB3414831.gif)
![CAS 189509-22-6 Ethyl 2-(8-hydroxy-1,4-dioxaspiro[4.5]decan-8-yl)acetate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/189509-22-6.gif)
