5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide

C17H20N2O2S2 — CID 97438421

IUPAC5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide
SMILESCC(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cccs3)C2)cs1
InChIInChI=1S/C17H20N2O2S2/c1-12(20)16-8-13(11-23-16)17(21)18-14-4-2-6-19(9-14)10-15-5-3-7-22-15/h3,5,7-8,11,14H,2,4,6,9-10H2,1H3,(H,18,21)/t14-/m1/s1
InChIKeyGOCVKMDCMRDXCQ-CQSZACIVSA-N
MW348.49 g/mol
LogP3.41
Rot. Bonds5

About 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide

5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide (PubChem CID 97438421) has the molecular formula C17H20N2O2S2 and a molecular weight of 348.49 g/mol. Its IUPAC name is 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide
PubChem CID97438421
Molecular FormulaC17H20N2O2S2
Molecular Weight348.49 g/mol
Exact Mass348.10
IUPAC Name5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide
SMILESCC(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cccs3)C2)cs1
InChIInChI=1S/C17H20N2O2S2/c1-12(20)16-8-13(11-23-16)17(21)18-14-4-2-6-19(9-14)10-15-5-3-7-22-15/h3,5,7-8,11,14H,2,4,6,9-10H2,1H3,(H,18,21)/t14-/m1/s1
InChIKeyGOCVKMDCMRDXCQ-CQSZACIVSA-N
XLogP3.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.49
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-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

4-(3-hydroxy-3-methylbutyl)-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]benzamide
CID 56911223
5-ethyl-4-(pyrrolidin-1-ylmethyl)-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]furan-2-carboxamide
CID 131889341
4-methyl-2-propan-2-yl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]-1,3-thiazole-5-carboxamide
CID 72909192
5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide
CID 131905750
N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide
CID 74247458
4-oxo-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]-3H-quinazoline-2-carboxamide
CID 137225427
2-[[[1-(thiophen-2-ylmethyl)piperidin-3-yl]amino]methyl]benzoic acid
CID 131904569
4-sulfamoyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]butanamide
CID 131929491
1-(3-chloro-4-methoxyphenyl)-3-[1-(thiophen-2-ylmethyl)piperidin-3-yl]urea
CID 131892413
4-[[1-(thiophen-2-ylmethyl)piperidin-3-yl]sulfamoyl]benzamide
CID 131920401
N-methyl-1-(thiophen-2-ylmethyl)pyrrolidin-3-amine
CID 60861984
3-(5-methyl-2-oxo-1,3-benzoxazol-3-yl)-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]propanamide
CID 131915591

Frequently Asked Questions

What is the IUPAC name of 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide?
The IUPAC name of 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide (CID 97438421) is 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide.
What is the SMILES notation for 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide?
The canonical SMILES for 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide is CC(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cccs3)C2)cs1.
What is the InChIKey of 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide?
The InChIKey is GOCVKMDCMRDXCQ-CQSZACIVSA-N. The full InChI is InChI=1S/C17H20N2O2S2/c1-12(20)16-8-13(11-23-16)17(21)18-14-4-2-6-19(9-14)10-15-5-3-7-22-15/h3,5,7-8,11,14H,2,4,6,9-10H2,1H3,(H,18,21)/t14-/m1/s1.
What are the key properties of 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide?
5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide has a molecular weight of 348.49 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide is sourced from PubChem (CID 97438421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).