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

C21H18N2O3 — CID 97016481

IUPACN-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide
SMILESO=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1occc1-c1ccccc1
InChIInChI=1S/C21H18N2O3/c24-19-13-16(14-23(19)17-9-5-2-6-10-17)22-21(25)20-18(11-12-26-20)15-7-3-1-4-8-15/h1-12,16H,13-14H2,(H,22,25)/t16-/m0/s1
InChIKeyNOVLXLATUWHJOS-INIZCTEOSA-N
MW346.39 g/mol
LogP3.48
Rot. Bonds4

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

N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide (PubChem CID 97016481) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide
PubChem CID97016481
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC NameN-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide
SMILESO=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1occc1-c1ccccc1
InChIInChI=1S/C21H18N2O3/c24-19-13-16(14-23(19)17-9-5-2-6-10-17)22-21(25)20-18(11-12-26-20)15-7-3-1-4-8-15/h1-12,16H,13-14H2,(H,22,25)/t16-/m0/s1
InChIKeyNOVLXLATUWHJOS-INIZCTEOSA-N
XLogP3.48
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclooctyl-3-phenylfuran-2-carboxamide
CID 35163513
N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-4-phenylbenzamide
CID 7563663
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
N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]thiophene-2-carboxamide
CID 7255002
1,1-dimethyl-3-(5-oxo-1-phenylpyrrolidin-3-yl)urea
CID 18564044
3,4-dimethyl-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 7546685
N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-1-benzofuran-2-carboxamide
CID 7255005
1-(1-hydroxy-2-methylpropan-2-yl)-3-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]urea
CID 7513340
3-chloro-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide
CID 16822090
N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-2-(trifluoromethyl)benzamide
CID 7546827
2,3,4-trifluoro-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide
CID 110736815

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide?
The IUPAC name of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide (CID 97016481) is N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide.
What is the SMILES notation for N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide?
The canonical SMILES for N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide is O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1occc1-c1ccccc1.
What is the InChIKey of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide?
The InChIKey is NOVLXLATUWHJOS-INIZCTEOSA-N. The full InChI is InChI=1S/C21H18N2O3/c24-19-13-16(14-23(19)17-9-5-2-6-10-17)22-21(25)20-18(11-12-26-20)15-7-3-1-4-8-15/h1-12,16H,13-14H2,(H,22,25)/t16-/m0/s1.
What are the key properties of N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide?
N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylfuran-2-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 3.48, 4 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]-3-phenylfuran-2-carboxamide is sourced from PubChem (CID 97016481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).