5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide

C21H26N2O2S — CID 131905750

IUPAC5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide
SMILESO=C(CCCC(=O)c1ccccc1)NC1CCCN(Cc2cccs2)C1
InChIInChI=1S/C21H26N2O2S/c24-20(17-7-2-1-3-8-17)11-4-12-21(25)22-18-9-5-13-23(15-18)16-19-10-6-14-26-19/h1-3,6-8,10,14,18H,4-5,9,11-13,15-16H2,(H,22,25)
InChIKeyZWUGRHQVECDKBY-UHFFFAOYSA-N
MW370.52 g/mol
LogP3.88
Rot. Bonds8

About 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide

5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide (PubChem CID 131905750) has the molecular formula C21H26N2O2S and a molecular weight of 370.52 g/mol. Its IUPAC name is 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide.

Molecular Properties

Compound Name5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide
PubChem CID131905750
Molecular FormulaC21H26N2O2S
Molecular Weight370.52 g/mol
Exact Mass370.17
IUPAC Name5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide
SMILESO=C(CCCC(=O)c1ccccc1)NC1CCCN(Cc2cccs2)C1
InChIInChI=1S/C21H26N2O2S/c24-20(17-7-2-1-3-8-17)11-4-12-21(25)22-18-9-5-13-23(15-18)16-19-10-6-14-26-19/h1-3,6-8,10,14,18H,4-5,9,11-13,15-16H2,(H,22,25)
InChIKeyZWUGRHQVECDKBY-UHFFFAOYSA-N
XLogP3.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.52
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-sulfamoyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]butanamide
CID 131929491
N-cyclooctyl-5-oxo-5-phenylpentanamide
CID 20969095
4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide
CID 56702621
2-[[[1-(thiophen-2-ylmethyl)piperidin-3-yl]amino]methyl]benzoic acid
CID 131904569
5-acetyl-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]thiophene-3-carboxamide
CID 97438421
N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]azepane-1-sulfonamide
CID 131895476
3-(5-methyl-2-oxo-1,3-benzoxazol-3-yl)-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]propanamide
CID 131915591
4-oxo-N-[(3R)-1-(thiophen-2-ylmethyl)piperidin-3-yl]-3H-quinazoline-2-carboxamide
CID 137225427
N-(1-benzylpiperidin-3-yl)-3-phenylpropanamide
CID 42958724
4-oxo-4-phenyl-N-[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]butanamide
CID 126851463
N-(1-benzylpiperidin-3-yl)butanamide
CID 60756097
4-(3-hydroxy-3-methylbutyl)-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]benzamide
CID 56911223

Frequently Asked Questions

What is the IUPAC name of 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide?
The IUPAC name of 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide (CID 131905750) is 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide.
What is the SMILES notation for 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide?
The canonical SMILES for 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide is O=C(CCCC(=O)c1ccccc1)NC1CCCN(Cc2cccs2)C1.
What is the InChIKey of 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide?
The InChIKey is ZWUGRHQVECDKBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2S/c24-20(17-7-2-1-3-8-17)11-4-12-21(25)22-18-9-5-13-23(15-18)16-19-10-6-14-26-19/h1-3,6-8,10,14,18H,4-5,9,11-13,15-16H2,(H,22,25).
What are the key properties of 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide?
5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide has a molecular weight of 370.52 g/mol, XLogP of 3.88, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-5-phenyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pentanamide is sourced from PubChem (CID 131905750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).