(3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide

C13H20N2OS — CID 81139457

IUPAC(3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide
SMILESCCC(NC(=O)[C@H]1CCCNC1)c1cccs1
InChIInChI=1S/C13H20N2OS/c1-2-11(12-6-4-8-17-12)15-13(16)10-5-3-7-14-9-10/h4,6,8,10-11,14H,2-3,5,7,9H2,1H3,(H,15,16)/t10-,11?/m0/s1
InChIKeyGPAWXLJCIRJRBE-VUWPPUDQSA-N
MW252.38 g/mol
LogP2.32
Rot. Bonds4

About (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide

(3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide (PubChem CID 81139457) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide
PubChem CID81139457
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC Name(3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide
SMILESCCC(NC(=O)[C@H]1CCCNC1)c1cccs1
InChIInChI=1S/C13H20N2OS/c1-2-11(12-6-4-8-17-12)15-13(16)10-5-3-7-14-9-10/h4,6,8,10-11,14H,2-3,5,7,9H2,1H3,(H,15,16)/t10-,11?/m0/s1
InChIKeyGPAWXLJCIRJRBE-VUWPPUDQSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-ethyl-1-thiophen-2-ylbutyl)piperidine-3-carboxamide
CID 119300996
(3R)-N-(2-methyl-1-thiophen-2-ylpropyl)piperidine-3-carboxamide
CID 81124404
N-(2-methyl-1-thiophen-2-ylpropyl)piperidine-3-carboxamide
CID 43709154
2-piperidin-3-yl-N-(1-thiophen-2-ylpropyl)acetamide
CID 62676887
N-(1-phenylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119279865
N-(2-phenyl-1-thiophen-2-ylethyl)pyrrolidine-3-carboxamide
CID 119794217
N-(1-thiophen-2-ylpropyl)piperidine-2-carboxamide
CID 54964031
N-(1-thiophen-2-ylethyl)pyrrolidine-3-carboxamide
CID 63006092
N-[1-(4-methoxyphenyl)propyl]piperidine-3-carboxamide
CID 43708609
(3R)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide
CID 81123819
N-(2-thiophen-2-ylethyl)piperidine-3-carboxamide;hydrochloride
CID 119270431
N-[3-methyl-1-(2-methylphenyl)butyl]piperidine-3-carboxamide;hydrochloride
CID 119323136

Frequently Asked Questions

What is the IUPAC name of (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide?
The IUPAC name of (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide (CID 81139457) is (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide.
What is the SMILES notation for (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide?
The canonical SMILES for (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide is CCC(NC(=O)[C@H]1CCCNC1)c1cccs1.
What is the InChIKey of (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide?
The InChIKey is GPAWXLJCIRJRBE-VUWPPUDQSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-2-11(12-6-4-8-17-12)15-13(16)10-5-3-7-14-9-10/h4,6,8,10-11,14H,2-3,5,7,9H2,1H3,(H,15,16)/t10-,11?/m0/s1.
What are the key properties of (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide?
(3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide has a molecular weight of 252.38 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide is sourced from PubChem (CID 81139457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).