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

C23H30N2O — CID 55714039

IUPAC2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
SMILESCc1ccc(C(=O)NCc2ccccc2CN2CCCC(C)C2)c(C)c1
InChIInChI=1S/C23H30N2O/c1-17-10-11-22(19(3)13-17)23(26)24-14-20-8-4-5-9-21(20)16-25-12-6-7-18(2)15-25/h4-5,8-11,13,18H,6-7,12,14-16H2,1-3H3,(H,24,26)
InChIKeyXYJJVCFRLODNIS-UHFFFAOYSA-N
MW350.51 g/mol
LogP4.47
Rot. Bonds5

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

2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide (PubChem CID 55714039) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
PubChem CID55714039
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Name2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
SMILESCc1ccc(C(=O)NCc2ccccc2CN2CCCC(C)C2)c(C)c1
InChIInChI=1S/C23H30N2O/c1-17-10-11-22(19(3)13-17)23(26)24-14-20-8-4-5-9-21(20)16-25-12-6-7-18(2)15-25/h4-5,8-11,13,18H,6-7,12,14-16H2,1-3H3,(H,24,26)
InChIKeyXYJJVCFRLODNIS-UHFFFAOYSA-N
XLogP4.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]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

2,5-dichloro-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]thiophene-3-carboxamide
CID 55718125
4-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzene-1,4-dicarboxamide
CID 60556119
2-ethylsulfonyl-N-[[2-[[(3R)-3-methylpiperidin-1-yl]methyl]phenyl]methyl]benzamide
CID 52610752
3-amino-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
CID 119845555
4-bromo-5-methyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-1H-pyrazole-3-carboxamide
CID 55885078
N-[[2-[[(3S)-3-methylpiperidin-1-yl]methyl]phenyl]methyl]-4-(methylsulfonylmethyl)benzamide
CID 51947396
2-methyl-N-[[2-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
CID 46476891
1-(2,4-dimethylphenyl)-2-(3-methylpiperidin-1-yl)ethanone
CID 43219443
N-[(2-methylphenyl)methyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 108996675
4-acetyl-3,5-dimethyl-N-[[2-[[(3S)-3-methylpiperidin-1-yl]methyl]phenyl]methyl]-1H-pyrrole-2-carboxamide
CID 51949843
6-cyclopropyl-1,3-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55725185
2-(4-acetamidophenyl)-N-[[2-[[(3S)-3-methylpiperidin-1-yl]methyl]phenyl]methyl]acetamide
CID 51947424

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide?
The IUPAC name of 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide (CID 55714039) is 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide.
What is the SMILES notation for 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide?
The canonical SMILES for 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide is Cc1ccc(C(=O)NCc2ccccc2CN2CCCC(C)C2)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide?
The InChIKey is XYJJVCFRLODNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c1-17-10-11-22(19(3)13-17)23(26)24-14-20-8-4-5-9-21(20)16-25-12-6-7-18(2)15-25/h4-5,8-11,13,18H,6-7,12,14-16H2,1-3H3,(H,24,26).
What are the key properties of 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide?
2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide has a molecular weight of 350.51 g/mol, XLogP of 4.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide is sourced from PubChem (CID 55714039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).