1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide

C16H24N2O2 — CID 71035260

IUPAC1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
SMILESCc1cccc(CNC(=O)C2CCN(CCO)CC2)c1
InChIInChI=1S/C16H24N2O2/c1-13-3-2-4-14(11-13)12-17-16(20)15-5-7-18(8-6-15)9-10-19/h2-4,11,15,19H,5-10,12H2,1H3,(H,17,20)
InChIKeyQGZDCQGPEHCUEM-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.32
Rot. Bonds5

About 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide

1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide (PubChem CID 71035260) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
PubChem CID71035260
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
SMILESCc1cccc(CNC(=O)C2CCN(CCO)CC2)c1
InChIInChI=1S/C16H24N2O2/c1-13-3-2-4-14(11-13)12-17-16(20)15-5-7-18(8-6-15)9-10-19/h2-4,11,15,19H,5-10,12H2,1H3,(H,17,20)
InChIKeyQGZDCQGPEHCUEM-UHFFFAOYSA-N
XLogP1.32
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylphenyl)methyl]cyclopentanecarboxamide
CID 39985159
1-[(2-chlorophenyl)methyl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
CID 45021309
4-amino-N-[(3-methylphenyl)methyl]cyclohexane-1-carboxamide
CID 60912945
N-[(3-methylphenyl)methyl]oxane-4-carboxamide
CID 30797255
1-(furan-2-carbonyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
CID 33280813
N-[(4-ethoxyphenyl)methyl]-1-[(3-methylphenyl)methyl]piperidine-4-carboxamide
CID 46774651
1-[(4-methylphenyl)methyl]-N-[[3-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide
CID 43917625
1-N-[(3-methylphenyl)methyl]-4-N-phenylcyclohexane-1,4-dicarboxamide
CID 109148085
4-N-[(3-methylphenyl)methyl]-1-N-(2-phenylethyl)cyclohexane-1,4-dicarboxamide
CID 109148068
1-[(4-methylphenyl)methyl]-N-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]piperidine-4-carboxamide
CID 43917627
1-(3,4-dimethylphenyl)sulfonyl-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
CID 38294416
1-(4-fluorophenyl)sulfonyl-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide
CID 38294766

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide (CID 71035260) is 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide is Cc1cccc(CNC(=O)C2CCN(CCO)CC2)c1.
What is the InChIKey of 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide?
The InChIKey is QGZDCQGPEHCUEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-13-3-2-4-14(11-13)12-17-16(20)15-5-7-18(8-6-15)9-10-19/h2-4,11,15,19H,5-10,12H2,1H3,(H,17,20).
What are the key properties of 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide?
1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 71035260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).