N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide

C18H20N2O2S — CID 31697369

IUPACN-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide
SMILESO=C(N[C@H](C(=O)N1CCCCC1)c1ccccc1)c1cccs1
InChIInChI=1S/C18H20N2O2S/c21-17(15-10-7-13-23-15)19-16(14-8-3-1-4-9-14)18(22)20-11-5-2-6-12-20/h1,3-4,7-10,13,16H,2,5-6,11-12H2,(H,19,21)/t16-/m0/s1
InChIKeyYAUOPOXZRZFOAH-INIZCTEOSA-N
MW328.44 g/mol
LogP3.23
Rot. Bonds4

About N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide

N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide (PubChem CID 31697369) has the molecular formula C18H20N2O2S and a molecular weight of 328.44 g/mol. Its IUPAC name is N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide
PubChem CID31697369
Molecular FormulaC18H20N2O2S
Molecular Weight328.44 g/mol
Exact Mass328.12
IUPAC NameN-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide
SMILESO=C(N[C@H](C(=O)N1CCCCC1)c1ccccc1)c1cccs1
InChIInChI=1S/C18H20N2O2S/c21-17(15-10-7-13-23-15)19-16(14-8-3-1-4-9-14)18(22)20-11-5-2-6-12-20/h1,3-4,7-10,13,16H,2,5-6,11-12H2,(H,19,21)/t16-/m0/s1
InChIKeyYAUOPOXZRZFOAH-INIZCTEOSA-N
XLogP3.23
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-benzamidopiperidin-1-yl)-2-oxo-1-phenylethyl]thiophene-2-carboxamide
CID 42931013
N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]thiophene-2-carboxamide
CID 1263443
4-N-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)benzene-1,4-dicarboxamide
CID 90833775
2-methyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
CID 110286837
4-chloro-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 110286769
2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 110286741
N-[2-oxo-1-phenyl-2-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide
CID 51113226
4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
CID 110286844
N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]-5-thiophen-2-ylpentanamide
CID 110306130
2,2-dimethyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]propanamide
CID 110286834
N-[(1S)-2-oxo-2-phenyl-1-piperidin-1-ylethyl]thiophene-2-carboxamide
CID 805573
2-methyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]-1H-pyrrole-3-carboxamide
CID 97221761

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
The IUPAC name of N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide (CID 31697369) is N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide is O=C(N[C@H](C(=O)N1CCCCC1)c1ccccc1)c1cccs1.
What is the InChIKey of N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
The InChIKey is YAUOPOXZRZFOAH-INIZCTEOSA-N. The full InChI is InChI=1S/C18H20N2O2S/c21-17(15-10-7-13-23-15)19-16(14-8-3-1-4-9-14)18(22)20-11-5-2-6-12-20/h1,3-4,7-10,13,16H,2,5-6,11-12H2,(H,19,21)/t16-/m0/s1.
What are the key properties of N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide has a molecular weight of 328.44 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide is sourced from PubChem (CID 31697369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).