3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide

C23H30N2O — CID 91573453

IUPAC3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide
SMILESCCC(C)C(C(=O)NC1CCNCC1c1ccccc1)c1ccccc1
InChIInChI=1S/C23H30N2O/c1-3-17(2)22(19-12-8-5-9-13-19)23(26)25-21-14-15-24-16-20(21)18-10-6-4-7-11-18/h4-13,17,20-22,24H,3,14-16H2,1-2H3,(H,25,26)
InChIKeyAVQJNKQOQXSVPE-UHFFFAOYSA-N
MW350.51 g/mol
LogP4.08
Rot. Bonds6

About 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide

3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide (PubChem CID 91573453) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide.

Molecular Properties

Compound Name3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide
PubChem CID91573453
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Name3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide
SMILESCCC(C)C(C(=O)NC1CCNCC1c1ccccc1)c1ccccc1
InChIInChI=1S/C23H30N2O/c1-3-17(2)22(19-12-8-5-9-13-19)23(26)25-21-14-15-24-16-20(21)18-10-6-4-7-11-18/h4-13,17,20-22,24H,3,14-16H2,1-2H3,(H,25,26)
InChIKeyAVQJNKQOQXSVPE-UHFFFAOYSA-N
XLogP4.08
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide 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-phenyl-N-(3-phenylpiperidin-4-yl)propanamide
CID 11500528
2-phenoxy-N-(3-phenylpiperidin-4-yl)propanamide
CID 69335454
N-[(1S,2S)-2-hydroxycyclohexyl]-3-methyl-2-phenylpentanamide
CID 104957118
N-(2-chlorocyclohexyl)-3-methyl-2-phenylpentanamide
CID 114301195
3-methyl-2-phenyl-N-pyrrolidin-3-ylbutanamide
CID 119449948
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-methyl-2-phenylpentanamide;hydrochloride
CID 119455950
N-(3-methylpiperidin-4-yl)-2-phenylbutanamide;hydrochloride
CID 120553376
(3R,4S)-N-methyl-3-phenylpiperidin-4-amine
CID 91006555
N,3-dimethyl-2-phenyl-N-piperidin-4-ylpentanamide
CID 43602183
N-(3-methylpiperidin-4-yl)-2-phenylpentanamide
CID 120556814
3-methyl-2-phenyl-N-(2-pyrrolidin-2-ylethyl)pentanamide
CID 114793980
2-amino-3-methyl-N-(2-phenylcyclopropyl)pentanamide;hydrochloride
CID 119709457

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide?
The IUPAC name of 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide (CID 91573453) is 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide.
What is the SMILES notation for 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide?
The canonical SMILES for 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide is CCC(C)C(C(=O)NC1CCNCC1c1ccccc1)c1ccccc1.
What is the InChIKey of 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide?
The InChIKey is AVQJNKQOQXSVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c1-3-17(2)22(19-12-8-5-9-13-19)23(26)25-21-14-15-24-16-20(21)18-10-6-4-7-11-18/h4-13,17,20-22,24H,3,14-16H2,1-2H3,(H,25,26).
What are the key properties of 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide?
3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide has a molecular weight of 350.51 g/mol, XLogP of 4.08, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-phenyl-N-(3-phenylpiperidin-4-yl)pentanamide is sourced from PubChem (CID 91573453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).