N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide

C16H22N2O2 — CID 134058787

IUPACN-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide
SMILESCC(C)CN(C)C(=O)c1cccc(N2CCCC2=O)c1
InChIInChI=1S/C16H22N2O2/c1-12(2)11-17(3)16(20)13-6-4-7-14(10-13)18-9-5-8-15(18)19/h4,6-7,10,12H,5,8-9,11H2,1-3H3
InChIKeyHFQGXZXFZFQKEW-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.54
Rot. Bonds4

About N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide

N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 134058787) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID134058787
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide
SMILESCC(C)CN(C)C(=O)c1cccc(N2CCCC2=O)c1
InChIInChI=1S/C16H22N2O2/c1-12(2)11-17(3)16(20)13-6-4-7-14(10-13)18-9-5-8-15(18)19/h4,6-7,10,12H,5,8-9,11H2,1-3H3
InChIKeyHFQGXZXFZFQKEW-UHFFFAOYSA-N
XLogP2.54
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-bromophenyl)methyl]-N-methyl-3-(2-oxopyrrolidin-1-yl)benzamide
CID 29213246
N-[(2,4-dimethylphenyl)methyl]-N-methyl-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9228105
2-[[(2R)-butan-2-yl]-[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]acetic acid
CID 124684573
N-methyl-3-(2-oxopyrrolidin-1-yl)-N-(3-phenoxypropyl)benzamide
CID 55654163
N-methyl-N-[(3-methylthiophen-2-yl)methyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9395109
N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9426335
3-(2-oxopiperidin-1-yl)benzoic acid
CID 24689039
N-[1-(3,4-difluorophenyl)ethyl]-N-methyl-3-(2-oxopyrrolidin-1-yl)benzamide
CID 46513080
N-[3-(dimethylamino)propyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 93174646
[2-(2-methylpropylamino)-2-oxoethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
CID 8727172
N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methyl-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9162156
N-methyl-N-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 95981005

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide (CID 134058787) is N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide is CC(C)CN(C)C(=O)c1cccc(N2CCCC2=O)c1.
What is the InChIKey of N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is HFQGXZXFZFQKEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12(2)11-17(3)16(20)13-6-4-7-14(10-13)18-9-5-8-15(18)19/h4,6-7,10,12H,5,8-9,11H2,1-3H3.
What are the key properties of N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide?
N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 274.36 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 134058787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).