N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide

C22H18N2O3S — CID 38715443

IUPACN-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)c1ccccc1C(=O)c1cccs1
InChIInChI=1S/C22H18N2O3S/c25-20-8-3-13-24(20)16-11-9-15(10-12-16)23-22(27)18-6-2-1-5-17(18)21(26)19-7-4-14-28-19/h1-2,4-7,9-12,14H,3,8,13H2,(H,23,27)
InChIKeyNHJNSWHPDHEXGV-UHFFFAOYSA-N
MW390.46 g/mol
LogP4.36
Rot. Bonds5

About N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide

N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide (PubChem CID 38715443) has the molecular formula C22H18N2O3S and a molecular weight of 390.46 g/mol. Its IUPAC name is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide.

Molecular Properties

Compound NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide
PubChem CID38715443
Molecular FormulaC22H18N2O3S
Molecular Weight390.46 g/mol
Exact Mass390.10
IUPAC NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)c1ccccc1C(=O)c1cccs1
InChIInChI=1S/C22H18N2O3S/c25-20-8-3-13-24(20)16-11-9-15(10-12-16)23-22(27)18-6-2-1-5-17(18)21(26)19-7-4-14-28-19/h1-2,4-7,9-12,14H,3,8,13H2,(H,23,27)
InChIKeyNHJNSWHPDHEXGV-UHFFFAOYSA-N
XLogP4.36
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686374
[4-(thiophene-2-carbonylamino)phenyl] 4-(2-oxopyrrolidin-1-yl)benzoate
CID 34752632
N-[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 9453685
2-methoxy-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686423
N-[(2S)-3-methyl-1-oxo-1-[4-(2-oxopyrrolidin-1-yl)anilino]butan-2-yl]thiophene-2-carboxamide
CID 8748790
[4-(thiophene-2-carbonylamino)phenyl] 4-(2-oxopiperidin-1-yl)benzoate
CID 32981938
N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide
CID 7687294
N-[2-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 30833133
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylthiophene-2-carboxamide
CID 26958545
N-[4-(cyclopropylcarbamoylamino)phenyl]-2-(thiophene-2-carbonyl)benzamide
CID 55531865
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 9265979
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide
CID 39942601

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide?
The IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide (CID 38715443) is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide.
What is the SMILES notation for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide?
The canonical SMILES for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide is O=C(Nc1ccc(N2CCCC2=O)cc1)c1ccccc1C(=O)c1cccs1.
What is the InChIKey of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide?
The InChIKey is NHJNSWHPDHEXGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O3S/c25-20-8-3-13-24(20)16-11-9-15(10-12-16)23-22(27)18-6-2-1-5-17(18)21(26)19-7-4-14-28-19/h1-2,4-7,9-12,14H,3,8,13H2,(H,23,27).
What are the key properties of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide?
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide has a molecular weight of 390.46 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-(thiophene-2-carbonyl)benzamide is sourced from PubChem (CID 38715443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).