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CAS 1092289-81-0 Ethyl 1-Carbamoylpiperidine-4-carboxylate molecular structure lightbox
CAS RN: 1092289-81-0

Ethyl 1-Carbamoylpiperidine-4-carboxylate

  • Product code: SSC-010314
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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, 5g, 10g, 0.1g, 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1092289-81-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 5 In Stock Shenzhen Inquiry
5g ≥95% 5 In Stock Hong Kong Inquiry
10g ≥95% 2 In Stock Beijing Inquiry
0.1g ≥95% 0 Out of Stock Beijing Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

1092289-81-0 / ethyl 1-carbamoylpiperidine-4-carboxylate

ethyl 1-carbamoylpiperidine-4-carboxylate | MFCD10690931 | SCHEMBL5010663

Standard CAS: 1092289-81-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1092289-81-0
Multi CAS
No
Molecular Formula
C9H16N2O3
Molecular Weight
200.230000
Exact Mass
200.116092
SMILES
CCOC(=O)C1CCN(CC1)C(=O)N
InChI
InChI=1S/C9H16N2O3/c1-2-14-8(12)7-3-5-11(6-4-7)9(10)13/h7H,2-6H2,1H3,(H2,10,13)
InChIKey
NVUZQOAIYGQCFR-UHFFFAOYSA-N
Synonyms
ethyl 1-carbamoylpiperidine-4-carboxylate MFCD10690931 SCHEMBL5010663 SCHEMBL7977253 AC2880

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.78
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
50.51
TPSA
72.63

LogP / Solubility

WLOGP
0.34
MLOGP
0.3
XLogP3
-0.1
Consensus LogP
0.18
Log S (ESOL)
-1.16
Class (ESOL)
Soluble
Log S (Ali)
-1.45
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.48
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.7

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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