4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide

C19H21N3O2 — CID 71839219

IUPAC4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESCN(C)c1ccc(C(=O)NC2CCN(c3ccccc3)C2=O)cc1
InChIInChI=1S/C19H21N3O2/c1-21(2)15-10-8-14(9-11-15)18(23)20-17-12-13-22(19(17)24)16-6-4-3-5-7-16/h3-11,17H,12-13H2,1-2H3,(H,20,23)
InChIKeyITSOTTVCEFJBMB-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.29
Rot. Bonds4

About 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide

4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide (PubChem CID 71839219) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
PubChem CID71839219
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESCN(C)c1ccc(C(=O)NC2CCN(c3ccccc3)C2=O)cc1
InChIInChI=1S/C19H21N3O2/c1-21(2)15-10-8-14(9-11-15)18(23)20-17-12-13-22(19(17)24)16-6-4-3-5-7-16/h3-11,17H,12-13H2,1-2H3,(H,20,23)
InChIKeyITSOTTVCEFJBMB-UHFFFAOYSA-N
XLogP2.29
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 95234404
3,5-dimethyl-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 95234364
3,4-dimethoxy-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
CID 136524569
3-methyl-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 164634853
3-fluoro-4-methyl-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 95234414
4-[(carbamoylamino)methyl]-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
CID 136524592
4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
CID 110745886
N-[1-(3-methylphenyl)-2-oxopyrrolidin-3-yl]-4-[methyl(prop-2-enoyl)amino]benzamide
CID 166413728
1-[4-(dimethylamino)phenyl]-3-(methylamino)pyrrolidin-2-one
CID 54973015
4-amino-3-nitro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 95239356
5-bromo-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]furan-2-carboxamide
CID 95234398
(3S)-N-[[4-(dimethylamino)phenyl]methyl]-2-oxo-1-phenylpyrrolidine-3-carboxamide
CID 92725760

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide (CID 71839219) is 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide is CN(C)c1ccc(C(=O)NC2CCN(c3ccccc3)C2=O)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The InChIKey is ITSOTTVCEFJBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-21(2)15-10-8-14(9-11-15)18(23)20-17-12-13-22(19(17)24)16-6-4-3-5-7-16/h3-11,17H,12-13H2,1-2H3,(H,20,23).
What are the key properties of 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide has a molecular weight of 323.40 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide is sourced from PubChem (CID 71839219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).