N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide

C22H26N2O2 — CID 113006519

IUPACN-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
SMILESCc1cccc(C(=O)N2CCC(C(=O)Nc3c(C)cccc3C)CC2)c1
InChIInChI=1S/C22H26N2O2/c1-15-6-4-9-19(14-15)22(26)24-12-10-18(11-13-24)21(25)23-20-16(2)7-5-8-17(20)3/h4-9,14,18H,10-13H2,1-3H3,(H,23,25)
InChIKeyFCCCIUQYHLTZDC-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.10
Rot. Bonds3

About N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide

N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide (PubChem CID 113006519) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
PubChem CID113006519
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
SMILESCc1cccc(C(=O)N2CCC(C(=O)Nc3c(C)cccc3C)CC2)c1
InChIInChI=1S/C22H26N2O2/c1-15-6-4-9-19(14-15)22(26)24-12-10-18(11-13-24)21(25)23-20-16(2)7-5-8-17(20)3/h4-9,14,18H,10-13H2,1-3H3,(H,23,25)
InChIKeyFCCCIUQYHLTZDC-UHFFFAOYSA-N
XLogP4.10
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,4-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113006439
N-(4-chloro-2-methylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113007275
N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113008221
N-(3,4-difluorophenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113008987
N-(4-ethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113006643
1-(3,4-dimethylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide
CID 113006126
N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 38646202
N-(2-methoxy-5-methylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113007595
N-(2-ethyl-6-methylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 113006739
methyl 2-[[1-(3-methylbenzoyl)piperidine-4-carbonyl]amino]benzoate
CID 113007945
N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide
CID 110820278
N-(2-chloro-4,6-dimethylphenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 113007362

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide (CID 113006519) is N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide is Cc1cccc(C(=O)N2CCC(C(=O)Nc3c(C)cccc3C)CC2)c1.
What is the InChIKey of N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
The InChIKey is FCCCIUQYHLTZDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-15-6-4-9-19(14-15)22(26)24-12-10-18(11-13-24)21(25)23-20-16(2)7-5-8-17(20)3/h4-9,14,18H,10-13H2,1-3H3,(H,23,25).
What are the key properties of N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 113006519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).