N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide

C16H24N2O — CID 81356926

IUPACN-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
SMILESCc1ccc([C@H](C)NC(=O)CC2CCCNC2)cc1
InChIInChI=1S/C16H24N2O/c1-12-5-7-15(8-6-12)13(2)18-16(19)10-14-4-3-9-17-11-14/h5-8,13-14,17H,3-4,9-11H2,1-2H3,(H,18,19)/t13-,14?/m0/s1
InChIKeyNOVWUVYSJOYTJW-LSLKUGRBSA-N
MW260.38 g/mol
LogP2.56
Rot. Bonds4

About N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide

N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide (PubChem CID 81356926) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
PubChem CID81356926
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
SMILESCc1ccc([C@H](C)NC(=O)CC2CCCNC2)cc1
InChIInChI=1S/C16H24N2O/c1-12-5-7-15(8-6-12)13(2)18-16(19)10-14-4-3-9-17-11-14/h5-8,13-14,17H,3-4,9-11H2,1-2H3,(H,18,19)/t13-,14?/m0/s1
InChIKeyNOVWUVYSJOYTJW-LSLKUGRBSA-N
XLogP2.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide 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

N-[(1R)-1-phenylethyl]-2-piperidin-3-ylacetamide
CID 78953201
N-[1-(3-hydroxyphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 62676485
(1R)-1-(4-methylphenyl)-N-(piperidin-3-ylmethyl)ethanamine
CID 81349439
N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-3-ylacetamide
CID 62677074
(3R)-N-[(1S)-1-(4-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81355974
2-methyl-N-[(1R)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylpropanamide
CID 83200384
2-piperidin-4-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide
CID 61030445
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-piperidin-3-ylacetamide
CID 62675416
2-piperidin-4-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 119686100
2-(cyclopropylmethylamino)-N-[1-(4-methylphenyl)ethyl]acetamide;hydrochloride
CID 119705801
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-piperidin-4-ylacetamide
CID 81354078
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-piperidin-4-ylacetamide
CID 81354394

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide?
The IUPAC name of N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide (CID 81356926) is N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide?
The canonical SMILES for N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide is Cc1ccc([C@H](C)NC(=O)CC2CCCNC2)cc1.
What is the InChIKey of N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide?
The InChIKey is NOVWUVYSJOYTJW-LSLKUGRBSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-5-7-15(8-6-12)13(2)18-16(19)10-14-4-3-9-17-11-14/h5-8,13-14,17H,3-4,9-11H2,1-2H3,(H,18,19)/t13-,14?/m0/s1.
What are the key properties of N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide?
N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide has a molecular weight of 260.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylacetamide is sourced from PubChem (CID 81356926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).