2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide

C15H22N2O — CID 43152403

IUPAC2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide
SMILESCc1ccc(CC(=O)NCC2CCNCC2)cc1
InChIInChI=1S/C15H22N2O/c1-12-2-4-13(5-3-12)10-15(18)17-11-14-6-8-16-9-7-14/h2-5,14,16H,6-11H2,1H3,(H,17,18)
InChIKeyBJCKABVHEDYPKP-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.65
Rot. Bonds4

About 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide

2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide (PubChem CID 43152403) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide
PubChem CID43152403
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide
SMILESCc1ccc(CC(=O)NCC2CCNCC2)cc1
InChIInChI=1S/C15H22N2O/c1-12-2-4-13(5-3-12)10-15(18)17-11-14-6-8-16-9-7-14/h2-5,14,16H,6-11H2,1H3,(H,17,18)
InChIKeyBJCKABVHEDYPKP-UHFFFAOYSA-N
XLogP1.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-aminocyclohexyl)methyl]-2-(4-methylphenyl)acetamide
CID 106124207
2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
CID 43603662
2-(4-methylphenyl)-1-piperidin-4-ylethanone
CID 82079035
2-(4-methylphenyl)-N-[[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]methyl]acetamide
CID 71866670
N-(cyclobutylmethyl)-2-(4-fluorophenyl)acetamide
CID 94168873
N-[[1-(2-cyanoacetyl)piperidin-4-yl]methyl]-2-(4-methylphenyl)acetamide
CID 108922214
N-[4-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]-N-[(4-methylphenyl)methyl]cyclopropanecarboxamide
CID 46052446
N-(cyclohexylmethyl)-2-(4-fluorophenyl)acetamide
CID 83278373
2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide
CID 113436646
2-cyano-N-[[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]methyl]acetamide
CID 108922213
2-(4-methylphenyl)-N-[(6-methylpiperidin-2-yl)methyl]acetamide
CID 55057430
N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride
CID 146064790

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide (CID 43152403) is 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide is Cc1ccc(CC(=O)NCC2CCNCC2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide?
The InChIKey is BJCKABVHEDYPKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-2-4-13(5-3-12)10-15(18)17-11-14-6-8-16-9-7-14/h2-5,14,16H,6-11H2,1H3,(H,17,18).
What are the key properties of 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide?
2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide has a molecular weight of 246.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide is sourced from PubChem (CID 43152403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).