N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide

C12H14N2O2 — CID 110736486

IUPACN-(1-methyl-5-oxopyrrolidin-3-yl)benzamide
SMILESCN1CC(NC(=O)c2ccccc2)CC1=O
InChIInChI=1S/C12H14N2O2/c1-14-8-10(7-11(14)15)13-12(16)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,16)
InChIKeyGQGICUVIYQFFQE-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.65
Rot. Bonds2

About N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide

N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide (PubChem CID 110736486) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide.

Molecular Properties

Compound NameN-(1-methyl-5-oxopyrrolidin-3-yl)benzamide
PubChem CID110736486
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-(1-methyl-5-oxopyrrolidin-3-yl)benzamide
SMILESCN1CC(NC(=O)c2ccccc2)CC1=O
InChIInChI=1S/C12H14N2O2/c1-14-8-10(7-11(14)15)13-12(16)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,16)
InChIKeyGQGICUVIYQFFQE-UHFFFAOYSA-N
XLogP0.65
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(1-methyl-5-oxopyrrolidin-3-yl)carbamoyl]benzoic acid
CID 119184714
N-(1-methyl-5-oxopyrrolidin-3-yl)-3-phenylbenzamide
CID 110736530
N-(1-methyl-5-oxopyrrolidin-3-yl)-3-oxo-3-phenylpropanamide
CID 110473177
N-(1-methyl-2,6-dioxopiperidin-4-yl)benzamide
CID 523504
methyl 3-[(1-methyl-5-oxopyrrolidin-3-yl)carbamoyl]benzoate
CID 60616666
3,4-dichloro-N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide
CID 110736500
N-[(3R,7R)-1-methyl-7-(4-methylpiperazine-1-carbonyl)-9-oxoazonan-3-yl]benzamide
CID 100618985
1-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]-3-(2-phenylethyl)urea
CID 94796717
N-(1-methyl-5-oxopyrrolidin-3-yl)-3-(propan-2-ylcarbamoylamino)benzamide
CID 60616745
N-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]-4-(5-oxo-1H-tetrazol-4-yl)benzamide
CID 166337265
N-(1-methyl-5-oxopyrrolidin-3-yl)-1H-indole-2-carboxamide
CID 110474030
N-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]-2-phenylsulfanylpyridine-3-carboxamide
CID 95304804

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide?
The IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide (CID 110736486) is N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide.
What is the SMILES notation for N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide?
The canonical SMILES for N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide is CN1CC(NC(=O)c2ccccc2)CC1=O.
What is the InChIKey of N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide?
The InChIKey is GQGICUVIYQFFQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-14-8-10(7-11(14)15)13-12(16)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,16).
What are the key properties of N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide?
N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide has a molecular weight of 218.26 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide is sourced from PubChem (CID 110736486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).