3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide

C20H22N2O2 — CID 7687280

IUPAC3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(N3CCCCC3=O)cc2)cc1C
InChIInChI=1S/C20H22N2O2/c1-14-6-7-16(13-15(14)2)20(24)21-17-8-10-18(11-9-17)22-12-4-3-5-19(22)23/h6-11,13H,3-5,12H2,1-2H3,(H,21,24)
InChIKeyIEDOPXWCIDZOHP-UHFFFAOYSA-N
MW322.41 g/mol
LogP4.07
Rot. Bonds3

About 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide

3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide (PubChem CID 7687280) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
PubChem CID7687280
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(N3CCCCC3=O)cc2)cc1C
InChIInChI=1S/C20H22N2O2/c1-14-6-7-16(13-15(14)2)20(24)21-17-8-10-18(11-9-17)22-12-4-3-5-19(22)23/h6-11,13H,3-5,12H2,1-2H3,(H,21,24)
InChIKeyIEDOPXWCIDZOHP-UHFFFAOYSA-N
XLogP4.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 9242933
N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18204867
3,4-dimethyl-N-[4-(2-oxo-1,3-diazinan-1-yl)phenyl]benzamide
CID 110666698
N-(4-chlorophenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36678322
4-acetamido-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 78788340
3-[(3,5-dimethylphenyl)sulfamoyl]-4-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 30399937
3,4,5-trimethoxy-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687225
3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687271
N-(2,5-dimethylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36675659
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dimethylbenzamide
CID 7686708
4-(2-oxopyrrolidin-1-yl)-N-(4-piperidin-1-ylphenyl)benzamide
CID 7922377
3-[(2,5-dimethylphenyl)sulfamoyl]-4-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 30379951

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
The IUPAC name of 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide (CID 7687280) is 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
The canonical SMILES for 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide is Cc1ccc(C(=O)Nc2ccc(N3CCCCC3=O)cc2)cc1C.
What is the InChIKey of 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
The InChIKey is IEDOPXWCIDZOHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-14-6-7-16(13-15(14)2)20(24)21-17-8-10-18(11-9-17)22-12-4-3-5-19(22)23/h6-11,13H,3-5,12H2,1-2H3,(H,21,24).
What are the key properties of 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide has a molecular weight of 322.41 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 7687280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).