N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide

C16H24N2O — CID 110850894

IUPACN-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide
SMILESCc1ccc(CNC(=O)CC2CCCCN2C)cc1
InChIInChI=1S/C16H24N2O/c1-13-6-8-14(9-7-13)12-17-16(19)11-15-5-3-4-10-18(15)2/h6-9,15H,3-5,10-12H2,1-2H3,(H,17,19)
InChIKeyBCZLYBNMDPULEP-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.49
Rot. Bonds4

About N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide

N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide (PubChem CID 110850894) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide
PubChem CID110850894
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide
SMILESCc1ccc(CNC(=O)CC2CCCCN2C)cc1
InChIInChI=1S/C16H24N2O/c1-13-6-8-14(9-7-13)12-17-16(19)11-15-5-3-4-10-18(15)2/h6-9,15H,3-5,10-12H2,1-2H3,(H,17,19)
InChIKeyBCZLYBNMDPULEP-UHFFFAOYSA-N
XLogP2.49
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110856796
N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110856788
N-(3H-benzimidazol-5-ylmethyl)-2-[(2R)-1-methylpiperidin-2-yl]acetamide
CID 126451275
N-[(4-cyanophenyl)methyl]-3-(1-methylpiperidin-2-yl)propanamide
CID 72901526
N-[3-(4-methylphenyl)propyl]-3-[(2R)-1-methylpiperidin-2-yl]propanamide
CID 97204902
2-(azepan-1-yl)-N-[(4-methylphenyl)methyl]acetamide
CID 108997193
N-[(4-methylphenyl)methyl]-2-(2-pyrrolidin-1-ylethyl)piperidine-1-carboxamide
CID 56914375
(2R)-N-[(4-methylphenyl)methyl]-2-(2-pyrrolidin-1-ylethyl)piperidine-1-carboxamide
CID 95728102
2-(1-cyclopropylpiperidin-4-yl)-N-[(4-methylphenyl)methyl]acetamide
CID 110754744
N-(2,6-dimethylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110857550
2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 110851953
N-[(4-fluoro-2-methoxyphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide
CID 119060434

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide (CID 110850894) is N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide is Cc1ccc(CNC(=O)CC2CCCCN2C)cc1.
What is the InChIKey of N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide?
The InChIKey is BCZLYBNMDPULEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13-6-8-14(9-7-13)12-17-16(19)11-15-5-3-4-10-18(15)2/h6-9,15H,3-5,10-12H2,1-2H3,(H,17,19).
What are the key properties of N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide?
N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 110850894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).