N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide

C20H24N2O — CID 53282361

IUPACN-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide
SMILESCc1cccc(NC(=O)c2ccc(N3CCCCC3)cc2)c1C
InChIInChI=1S/C20H24N2O/c1-15-7-6-8-19(16(15)2)21-20(23)17-9-11-18(12-10-17)22-13-4-3-5-14-22/h6-12H,3-5,13-14H2,1-2H3,(H,21,23)
InChIKeyUAXZRKHLGKWTIH-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.55
Rot. Bonds3

About N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide

N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide (PubChem CID 53282361) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide
PubChem CID53282361
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC NameN-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide
SMILESCc1cccc(NC(=O)c2ccc(N3CCCCC3)cc2)c1C
InChIInChI=1S/C20H24N2O/c1-15-7-6-8-19(16(15)2)21-20(23)17-9-11-18(12-10-17)22-13-4-3-5-14-22/h6-12H,3-5,13-14H2,1-2H3,(H,21,23)
InChIKeyUAXZRKHLGKWTIH-UHFFFAOYSA-N
XLogP4.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylphenyl)-4-(4-hydroxypiperidin-1-yl)benzamide
CID 111331495
N'-(2,3-dimethylphenyl)-N-(4-pyrrolidin-1-ylphenyl)oxamide
CID 108986873
N-(2,5-dimethylphenyl)-4-piperidin-1-ylbenzamide
CID 53282282
N-(2,4-dimethylphenyl)-4-piperidin-1-ylbenzamide
CID 21173697
4-piperidin-1-yl-N-(2,4,6-trimethylphenyl)benzamide
CID 21368177
N-(2,3-dimethylphenyl)-6-(4-phenylpiperazin-1-yl)pyridine-3-carboxamide
CID 109159593
N-(2,3-dimethylphenyl)-4-fluorobenzamide
CID 795282
4-piperidin-1-yl-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 21367427
4-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methyl-4-morpholin-4-ylphenyl)benzamide
CID 37317926
4-methyl-N-(2-methyl-4-pyrrolidin-1-ylphenyl)benzamide
CID 42157583
N-phenyl-4-piperidin-1-ylbenzamide
CID 53282261
N-(2,3-dimethylphenyl)-5-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
CID 109193453

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide?
The IUPAC name of N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide (CID 53282361) is N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide is Cc1cccc(NC(=O)c2ccc(N3CCCCC3)cc2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide?
The InChIKey is UAXZRKHLGKWTIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-15-7-6-8-19(16(15)2)21-20(23)17-9-11-18(12-10-17)22-13-4-3-5-14-22/h6-12H,3-5,13-14H2,1-2H3,(H,21,23).
What are the key properties of N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide?
N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide has a molecular weight of 308.43 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-4-piperidin-1-ylbenzamide is sourced from PubChem (CID 53282361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).