N-[(2-methylphenyl)methyl]piperidine-1-carboxamide

C14H20N2O — CID 108897154

IUPACN-[(2-methylphenyl)methyl]piperidine-1-carboxamide
SMILESCc1ccccc1CNC(=O)N1CCCCC1
InChIInChI=1S/C14H20N2O/c1-12-7-3-4-8-13(12)11-15-14(17)16-9-5-2-6-10-16/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,15,17)
InChIKeyCLGQZYIONRWWQE-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.69
Rot. Bonds2

About N-[(2-methylphenyl)methyl]piperidine-1-carboxamide

N-[(2-methylphenyl)methyl]piperidine-1-carboxamide (PubChem CID 108897154) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[(2-methylphenyl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2-methylphenyl)methyl]piperidine-1-carboxamide
PubChem CID108897154
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-[(2-methylphenyl)methyl]piperidine-1-carboxamide
SMILESCc1ccccc1CNC(=O)N1CCCCC1
InChIInChI=1S/C14H20N2O/c1-12-7-3-4-8-13(12)11-15-14(17)16-9-5-2-6-10-16/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,15,17)
InChIKeyCLGQZYIONRWWQE-UHFFFAOYSA-N
XLogP2.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(cyclohexanecarbonyl)-N-[(2-methylphenyl)methyl]piperazine-1-carboxamide
CID 84528878
3-(azepan-1-yl)-2,2-dimethyl-N-[(2-methylphenyl)methyl]-3-oxopropanamide
CID 108961716
N-[(2-methylphenyl)methyl]-4-propylpiperazine-1-carboxamide
CID 113103138
N-[(2-fluorophenyl)methyl]piperidine-1-carboxamide
CID 108897499
N-[(2-methylphenyl)methyl]-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 108897251
N-[(2-methoxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 38150329
N-[(2-methylphenyl)methyl]-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetamide
CID 30738049
4-(2,4-dimethylphenyl)-N-[(2-methylphenyl)methyl]piperazine-1-carboxamide
CID 113106748
4-(4-tert-butylphenyl)-N-[(2-methylphenyl)methyl]piperazine-1-carboxamide
CID 113106761
N-[(2-methylphenyl)methyl]-3-(2-methylpiperidin-1-yl)azetidine-1-carboxamide
CID 119074138
N-benzylazonane-1-carboxamide
CID 130689649
4-(2-anilino-2-oxoethyl)-N-[(2-methylphenyl)methyl]piperazine-1-carboxamide
CID 87000001

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylphenyl)methyl]piperidine-1-carboxamide?
The IUPAC name of N-[(2-methylphenyl)methyl]piperidine-1-carboxamide (CID 108897154) is N-[(2-methylphenyl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[(2-methylphenyl)methyl]piperidine-1-carboxamide?
The canonical SMILES for N-[(2-methylphenyl)methyl]piperidine-1-carboxamide is Cc1ccccc1CNC(=O)N1CCCCC1.
What is the InChIKey of N-[(2-methylphenyl)methyl]piperidine-1-carboxamide?
The InChIKey is CLGQZYIONRWWQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-12-7-3-4-8-13(12)11-15-14(17)16-9-5-2-6-10-16/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,15,17).
What are the key properties of N-[(2-methylphenyl)methyl]piperidine-1-carboxamide?
N-[(2-methylphenyl)methyl]piperidine-1-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylphenyl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 108897154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).