N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide

C19H16N2O3 — CID 7255005

IUPACN-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide
SMILESO=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cc2ccccc2o1
InChIInChI=1S/C19H16N2O3/c22-18-11-14(12-21(18)15-7-2-1-3-8-15)20-19(23)17-10-13-6-4-5-9-16(13)24-17/h1-10,14H,11-12H2,(H,20,23)/t14-/m0/s1
InChIKeyOAZPHCIZQCVLLC-AWEZNQCLSA-N
MW320.35 g/mol
LogP2.97
Rot. Bonds3

About N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide

N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide (PubChem CID 7255005) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide
PubChem CID7255005
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC NameN-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide
SMILESO=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cc2ccccc2o1
InChIInChI=1S/C19H16N2O3/c22-18-11-14(12-21(18)15-7-2-1-3-8-15)20-19(23)17-10-13-6-4-5-9-16(13)24-17/h1-10,14H,11-12H2,(H,20,23)/t14-/m0/s1
InChIKeyOAZPHCIZQCVLLC-AWEZNQCLSA-N
XLogP2.97
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-oxo-N-(5-oxo-1-phenylpyrrolidin-3-yl)chromene-3-carboxamide
CID 16822106
4-oxo-N-(5-oxo-1-phenylpyrrolidin-3-yl)chromene-2-carboxamide
CID 71936874
N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]-1-benzofuran-2-carboxamide
CID 7255754
N-[1-[(2-chlorophenyl)methyl]-5-oxopyrrolidin-3-yl]-1-benzofuran-2-carboxamide
CID 45177959
N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]-2-oxochromene-3-carboxamide
CID 7564441
N-[(3R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]-2-oxochromene-3-carboxamide
CID 7564205
3,4-dimethyl-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 7546685
2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 7546766
2-fluoro-N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 7546765
cis-(1R,3S)-3-(1-benzofuran-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 97318321
3-chloro-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide
CID 16822090
(2R)-2-amino-N-(5-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 119305747

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide (CID 7255005) is N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide is O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cc2ccccc2o1.
What is the InChIKey of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide?
The InChIKey is OAZPHCIZQCVLLC-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H16N2O3/c22-18-11-14(12-21(18)15-7-2-1-3-8-15)20-19(23)17-10-13-6-4-5-9-16(13)24-17/h1-10,14H,11-12H2,(H,20,23)/t14-/m0/s1.
What are the key properties of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide?
N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 7255005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).