2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide

C14H20N2O — CID 113436646

IUPAC2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide
SMILESCc1ccc(CC(=O)N[C@@H]2CCCNC2)cc1
InChIInChI=1S/C14H20N2O/c1-11-4-6-12(7-5-11)9-14(17)16-13-3-2-8-15-10-13/h4-7,13,15H,2-3,8-10H2,1H3,(H,16,17)/t13-/m1/s1
InChIKeyINCUZBSIEMZANB-CYBMUJFWSA-N
MW232.33 g/mol
LogP1.41
Rot. Bonds3

About 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide

2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide (PubChem CID 113436646) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide
PubChem CID113436646
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide
SMILESCc1ccc(CC(=O)N[C@@H]2CCCNC2)cc1
InChIInChI=1S/C14H20N2O/c1-11-4-6-12(7-5-11)9-14(17)16-13-3-2-8-15-10-13/h4-7,13,15H,2-3,8-10H2,1H3,(H,16,17)/t13-/m1/s1
InChIKeyINCUZBSIEMZANB-CYBMUJFWSA-N
XLogP1.41
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
CID 43603662
2-(3,4-dimethylphenyl)-N-[(3S)-piperidin-3-yl]acetamide
CID 94471135
3-(2,4-dimethylphenyl)-N-piperidin-3-ylpropanamide;hydrochloride
CID 91645265
4-(4-methylphenyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119453431
2-[4-(difluoromethylsulfonyl)phenyl]-N-piperidin-3-ylacetamide
CID 119426046
5-methyl-N-piperidin-3-ylfuran-2-carboxamide
CID 43603726
2-(4-methylphenoxy)-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 94803257
2-(4-chlorophenyl)-N-pyrrolidin-3-ylacetamide
CID 62379159
2-phenyl-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 79688083
2-(4-methylphenoxy)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119450091
N-piperidin-3-ylpropanamide
CID 3520588
2-(3-methyl-2-pyridinyl)-N-[(3S)-piperidin-3-yl]acetamide
CID 107148570

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide (CID 113436646) is 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide is Cc1ccc(CC(=O)N[C@@H]2CCCNC2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide?
The InChIKey is INCUZBSIEMZANB-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11-4-6-12(7-5-11)9-14(17)16-13-3-2-8-15-10-13/h4-7,13,15H,2-3,8-10H2,1H3,(H,16,17)/t13-/m1/s1.
What are the key properties of 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide?
2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide has a molecular weight of 232.33 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide is sourced from PubChem (CID 113436646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).