N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide

C22H26N2O2 — CID 109044864

IUPACN-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide
SMILESCc1ccc(CNC(=O)c2ccc(C(=O)N3CCC(C)CC3)cc2)cc1
InChIInChI=1S/C22H26N2O2/c1-16-3-5-18(6-4-16)15-23-21(25)19-7-9-20(10-8-19)22(26)24-13-11-17(2)12-14-24/h3-10,17H,11-15H2,1-2H3,(H,23,25)
InChIKeyDZJOHUXRKCIOCI-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.80
Rot. Bonds4

About N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide

N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide (PubChem CID 109044864) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide
PubChem CID109044864
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide
SMILESCc1ccc(CNC(=O)c2ccc(C(=O)N3CCC(C)CC3)cc2)cc1
InChIInChI=1S/C22H26N2O2/c1-16-3-5-18(6-4-16)15-23-21(25)19-7-9-20(10-8-19)22(26)24-13-11-17(2)12-14-24/h3-10,17H,11-15H2,1-2H3,(H,23,25)
InChIKeyDZJOHUXRKCIOCI-UHFFFAOYSA-N
XLogP3.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide 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

4-(4-methylpiperidine-1-carbonyl)-N-(pyridin-4-ylmethyl)benzamide
CID 109044877
(4-methylphenyl)-(4-methylpiperidin-1-yl)methanone
CID 723102
N-[(4-ethylphenyl)methyl]-2-[1-(4-methylbenzoyl)piperidin-4-yl]acetamide
CID 46295096
[4-[4-[2-(4-methylphenyl)ethyl]piperidine-1-carbonyl]phenyl]methylurea
CID 25492389
N-benzyl-4-[(4-methylpiperidin-1-yl)methyl]benzamide
CID 43918767
N',4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-1-carboximidamide
CID 111212093
1-(3,4-difluorobenzoyl)-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 113004061
N-[(4-methylphenyl)methyl]-4-[3-(4-methylpiperidin-1-yl)pyrazin-2-yl]oxybenzamide
CID 46394298
N-benzyl-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081809
N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 20956106
N-[[4-(4-hydroxypiperidine-1-carbonyl)phenyl]methyl]acetamide
CID 43393426
(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)phenyl]methanone
CID 86977180

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
The IUPAC name of N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide (CID 109044864) is N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
The canonical SMILES for N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide is Cc1ccc(CNC(=O)c2ccc(C(=O)N3CCC(C)CC3)cc2)cc1.
What is the InChIKey of N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
The InChIKey is DZJOHUXRKCIOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-16-3-5-18(6-4-16)15-23-21(25)19-7-9-20(10-8-19)22(26)24-13-11-17(2)12-14-24/h3-10,17H,11-15H2,1-2H3,(H,23,25).
What are the key properties of N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide has a molecular weight of 350.46 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylphenyl)methyl]-4-(4-methylpiperidine-1-carbonyl)benzamide is sourced from PubChem (CID 109044864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).