CAS RN: 1185319-51-0
N-Piperidin-3-yl-2-thiophen-3-yl-acetaMide hydrochloride, 98+% C11H17ClN2OS, MW: 260.83
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.20250611 | 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1185319-51-0
- Purity/Analytical Methods: >99.0%
1185319-51-0 / N-piperidin-3-yl-2-thiophen-3-ylacetamide;hydrochloride
N-(Piperidin-3-yl)-2-(thiophen-3-yl)acetamide hydrochloride | N-piperidin-3-yl-2-thiophen-3-ylacetamide;hydrochloride | N-Piperidin-3-yl-2-thiophen-3-yl-acetamide hydrochloride
Basic Information
CAS
1185319-51-0
Multi CAS
No
Molecular Formula
C11H17ClN2OS
Molecular Weight
260.780000
Exact Mass
260.075012
SMILES
C1CC(CNC1)NC(=O)CC2=CSC=C2.Cl
InChI
InChI=1S/C11H16N2OS.ClH/c14-11(6-9-3-5-15-8-9)13-10-2-1-4-12-7-10;/h3,5,8,10,12H,1-2,4,6-7H2,(H,13,14);1H
InChIKey
GATPSUBQGPIYSL-UHFFFAOYSA-N
Synonyms
N-(Piperidin-3-yl)-2-(thiophen-3-yl)acetamide hydrochloride
N-piperidin-3-yl-2-thiophen-3-ylacetamide;hydrochloride
N-Piperidin-3-yl-2-thiophen-3-yl-acetamide hydrochloride
N-Piperidin-3-yl-2-thiophen-3-yl-acetaMide hydrochloride, 98+% C11H17ClN2OS, MW
DTXSID00671618
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
5
Fraction Csp3
0.55
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
69.31
TPSA
41.13
LogP / Solubility
WLOGP
1.58
MLOGP
1.4
XLogP3
1.58
Consensus LogP
1.52
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.84
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.03
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)
-3.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
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