3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide

C22H28N2O — CID 112504560

IUPAC3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide
SMILESCc1cccc(C(=O)NCC(c2ccccc2)N2CCC(C)CC2)c1
InChIInChI=1S/C22H28N2O/c1-17-11-13-24(14-12-17)21(19-8-4-3-5-9-19)16-23-22(25)20-10-6-7-18(2)15-20/h3-10,15,17,21H,11-14,16H2,1-2H3,(H,23,25)
InChIKeyVUZLHGCHOGEVAO-UHFFFAOYSA-N
MW336.48 g/mol
LogP4.20
Rot. Bonds5

About 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide

3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide (PubChem CID 112504560) has the molecular formula C22H28N2O and a molecular weight of 336.48 g/mol. Its IUPAC name is 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide
PubChem CID112504560
Molecular FormulaC22H28N2O
Molecular Weight336.48 g/mol
Exact Mass336.22
IUPAC Name3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide
SMILESCc1cccc(C(=O)NCC(c2ccccc2)N2CCC(C)CC2)c1
InChIInChI=1S/C22H28N2O/c1-17-11-13-24(14-12-17)21(19-8-4-3-5-9-19)16-23-22(25)20-10-6-7-18(2)15-20/h3-10,15,17,21H,11-14,16H2,1-2H3,(H,23,25)
InChIKeyVUZLHGCHOGEVAO-UHFFFAOYSA-N
XLogP4.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]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

3-methyl-N-(2-phenyl-2-piperidin-1-ylethyl)benzamide
CID 45155327
3-methyl-N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43842823
N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ylethyl]-3-methylbenzamide
CID 35579010
2-fluoro-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide
CID 112504562
N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]benzamide
CID 43006371
4-(difluoromethylsulfonyl)-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide
CID 60551422
N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 35180369
N-[2-(4-methylpiperidin-1-yl)propyl]benzamide
CID 112502434
3-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]pyrazine-2-carboxamide
CID 60552065
3-amino-N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]benzamide
CID 119830765
2-amino-2-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]propanamide
CID 119860442
N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 60551856

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide?
The IUPAC name of 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide (CID 112504560) is 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide.
What is the SMILES notation for 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide?
The canonical SMILES for 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide is Cc1cccc(C(=O)NCC(c2ccccc2)N2CCC(C)CC2)c1.
What is the InChIKey of 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide?
The InChIKey is VUZLHGCHOGEVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O/c1-17-11-13-24(14-12-17)21(19-8-4-3-5-9-19)16-23-22(25)20-10-6-7-18(2)15-20/h3-10,15,17,21H,11-14,16H2,1-2H3,(H,23,25).
What are the key properties of 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide?
3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide has a molecular weight of 336.48 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]benzamide is sourced from PubChem (CID 112504560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).