2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide

C20H24N2O — CID 70002970

IUPAC2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide
SMILESNC(=O)Cc1ccc(CN2CCC(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H24N2O/c21-20(23)14-16-6-8-17(9-7-16)15-22-12-10-19(11-13-22)18-4-2-1-3-5-18/h1-9,19H,10-15H2,(H2,21,23)
InChIKeyJVHUQRFTJGSYCK-UHFFFAOYSA-N
MW308.43 g/mol
LogP3.09
Rot. Bonds5

About 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide

2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide (PubChem CID 70002970) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide
PubChem CID70002970
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide
SMILESNC(=O)Cc1ccc(CN2CCC(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H24N2O/c21-20(23)14-16-6-8-17(9-7-16)15-22-12-10-19(11-13-22)18-4-2-1-3-5-18/h1-9,19H,10-15H2,(H2,21,23)
InChIKeyJVHUQRFTJGSYCK-UHFFFAOYSA-N
XLogP3.09
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide 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-phenylpiperidin-1-yl)methyl]benzoic acid;hydrochloride
CID 146018012
N-hydroxy-4-[(4-phenylpiperidin-1-yl)methyl]benzamide
CID 163366143
4-(1-benzylpiperidin-4-yl)benzoic acid
CID 125492559
3-[(4-phenylpiperidin-1-yl)methyl]benzoic acid
CID 122028587
N-methyl-4-[[(4R)-4-phenylazepan-1-yl]methyl]benzamide
CID 95176105
4-phenyl-1-(2-phenylethyl)piperidine;propanamide
CID 175431355
4-[[4-(3-chlorophenyl)piperidin-1-yl]methyl]benzoic acid
CID 122033759
2-[3-(1-benzylpiperidin-4-yl)-2-nitrophenyl]acetamide
CID 142777077
4-[(3-phenylpyrrolidin-1-yl)methyl]benzenecarboximidamide
CID 62133576
1-[(4-fluorophenyl)methyl]-3-phenylpyrrolidine
CID 60603464
2-[4-((1,2,3,4,5,6-13C6)cyclohexatrienyl)(3,4,5-13C3)azinan-1-yl]-1,1,2,2-tetradeuterio(113C)ethanamine
CID 89308417
2-[4-[[4-[(4-phenylmethoxyphenyl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide
CID 90717393

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide?
The IUPAC name of 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide (CID 70002970) is 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide.
What is the SMILES notation for 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide?
The canonical SMILES for 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide is NC(=O)Cc1ccc(CN2CCC(c3ccccc3)CC2)cc1.
What is the InChIKey of 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide?
The InChIKey is JVHUQRFTJGSYCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c21-20(23)14-16-6-8-17(9-7-16)15-22-12-10-19(11-13-22)18-4-2-1-3-5-18/h1-9,19H,10-15H2,(H2,21,23).
What are the key properties of 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide?
2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide has a molecular weight of 308.43 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-phenylpiperidin-1-yl)methyl]phenyl]acetamide is sourced from PubChem (CID 70002970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).