N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide

C21H23N3O3 — CID 8968015

IUPACN-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide
SMILESCNC(=O)c1ccc(CN(C)C(=O)c2ccccc2N2CCCC2=O)cc1
InChIInChI=1S/C21H23N3O3/c1-22-20(26)16-11-9-15(10-12-16)14-23(2)21(27)17-6-3-4-7-18(17)24-13-5-8-19(24)25/h3-4,6-7,9-12H,5,8,13-14H2,1-2H3,(H,22,26)
InChIKeyWMWSULIRCYCGOJ-UHFFFAOYSA-N
MW365.43 g/mol
LogP2.45
Rot. Bonds5

About N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide

N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 8968015) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID8968015
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC NameN-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide
SMILESCNC(=O)c1ccc(CN(C)C(=O)c2ccccc2N2CCCC2=O)cc1
InChIInChI=1S/C21H23N3O3/c1-22-20(26)16-11-9-15(10-12-16)14-23(2)21(27)17-6-3-4-7-18(17)24-13-5-8-19(24)25/h3-4,6-7,9-12H,5,8,13-14H2,1-2H3,(H,22,26)
InChIKeyWMWSULIRCYCGOJ-UHFFFAOYSA-N
XLogP2.45
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-(2-oxopyrrolidin-1-yl)benzamide
CID 36670953
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CID 94821305
[(2R)-1-[benzyl(methyl)amino]-1-oxopropan-2-yl] 2-(2-oxopyrrolidin-1-yl)benzoate
CID 9132504
N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(2-oxopyrrolidin-1-yl)benzamide
CID 9378702
2-(2-oxopyrrolidin-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 8589720
N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]naphthalene-2-carboxamide
CID 8964487
N-(2-amino-2-oxoethyl)-2-(2-oxopyrrolidin-1-yl)benzamide
CID 9297068
N-[(4-ethoxyphenyl)methyl]-N-methyl-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27822823
N-benzyl-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27666071
(3S)-1-(2-ethylphenyl)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 8967033
N-methyl-4-[[methyl-[2-(9-oxoacridin-10-yl)acetyl]amino]methyl]benzamide
CID 38744100
N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-9H-fluorene-2-carboxamide
CID 38741293

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide (CID 8968015) is N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide is CNC(=O)c1ccc(CN(C)C(=O)c2ccccc2N2CCCC2=O)cc1.
What is the InChIKey of N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is WMWSULIRCYCGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-22-20(26)16-11-9-15(10-12-16)14-23(2)21(27)17-6-3-4-7-18(17)24-13-5-8-19(24)25/h3-4,6-7,9-12H,5,8,13-14H2,1-2H3,(H,22,26).
What are the key properties of N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide?
N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 365.43 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-2-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 8968015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).