N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide

C18H20N2O2S — CID 51082883

IUPACN-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NC(CN1CCCC1=O)c1ccccc1
InChIInChI=1S/C18H20N2O2S/c21-17(12-15-8-5-11-23-15)19-16(14-6-2-1-3-7-14)13-20-10-4-9-18(20)22/h1-3,5-8,11,16H,4,9-10,12-13H2,(H,19,21)
InChIKeyKTPCUGISIBAVHA-UHFFFAOYSA-N
MW328.44 g/mol
LogP2.77
Rot. Bonds6

About N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide

N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide (PubChem CID 51082883) has the molecular formula C18H20N2O2S and a molecular weight of 328.44 g/mol. Its IUPAC name is N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide
PubChem CID51082883
Molecular FormulaC18H20N2O2S
Molecular Weight328.44 g/mol
Exact Mass328.12
IUPAC NameN-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NC(CN1CCCC1=O)c1ccccc1
InChIInChI=1S/C18H20N2O2S/c21-17(12-15-8-5-11-23-15)19-16(14-6-2-1-3-7-14)13-20-10-4-9-18(20)22/h1-3,5-8,11,16H,4,9-10,12-13H2,(H,19,21)
InChIKeyKTPCUGISIBAVHA-UHFFFAOYSA-N
XLogP2.77
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]acetamide;hydrochloride
CID 119287067
N-(2-chloro-1-phenylethyl)-2-thiophen-2-ylacetamide
CID 113272323
N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]thiophene-3-carboxamide
CID 47043425
N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2-thiophen-2-ylacetamide
CID 95942009
N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-(4,5,6,7-tetrahydro-1H-indazol-3-yl)acetamide
CID 139000569
3-methoxy-N-[(1R)-2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]thiophene-2-carboxamide
CID 96549349
N-[(1R)-2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 94198507
N-[4-oxo-4-[[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]amino]butyl]cyclopropanecarboxamide
CID 55749883
N-benzhydryl-2-thiophen-2-ylacetamide
CID 785978
N-[3-oxo-3-[[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]amino]propyl]furan-2-carboxamide
CID 55750164
1-(2-oxo-2-pyrrolidin-1-ylethyl)-3-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]urea
CID 87003255
N-[(1S)-2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-(3-phenyl-1,2,4-triazol-1-yl)acetamide
CID 99617884

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide (CID 51082883) is N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)NC(CN1CCCC1=O)c1ccccc1.
What is the InChIKey of N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide?
The InChIKey is KTPCUGISIBAVHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2S/c21-17(12-15-8-5-11-23-15)19-16(14-6-2-1-3-7-14)13-20-10-4-9-18(20)22/h1-3,5-8,11,16H,4,9-10,12-13H2,(H,19,21).
What are the key properties of N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide?
N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide has a molecular weight of 328.44 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 51082883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).