N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide

C15H22N2O2 — CID 110012074

IUPACN-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide
SMILESCc1cccc(C(O)CNC(=O)C2CCNCC2)c1
InChIInChI=1S/C15H22N2O2/c1-11-3-2-4-13(9-11)14(18)10-17-15(19)12-5-7-16-8-6-12/h2-4,9,12,14,16,18H,5-8,10H2,1H3,(H,17,19)
InChIKeyQLFDJVDSLCJONX-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.14
Rot. Bonds4

About N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide

N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide (PubChem CID 110012074) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide
PubChem CID110012074
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide
SMILESCc1cccc(C(O)CNC(=O)C2CCNCC2)c1
InChIInChI=1S/C15H22N2O2/c1-11-3-2-4-13(9-11)14(18)10-17-15(19)12-5-7-16-8-6-12/h2-4,9,12,14,16,18H,5-8,10H2,1H3,(H,17,19)
InChIKeyQLFDJVDSLCJONX-UHFFFAOYSA-N
XLogP1.14
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[bis(3-methylphenyl)methyl]piperidine-4-carboxamide
CID 119338864
N-[2-hydroxy-3-(3-methylphenoxy)propyl]piperidine-4-carboxamide
CID 119304938
N-[2-(3-methylphenoxy)butyl]piperidine-4-carboxamide
CID 119344253
N-(2-phenylbutyl)piperidine-4-carboxamide;hydrochloride
CID 119271710
N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 119293173
N-[(2S)-2-(3-chlorophenyl)-2-hydroxyethyl]cyclohexanecarboxamide
CID 51941928
N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119849719
2-(cyclopropylamino)-1-(3-methylphenyl)ethanol
CID 62774704
N-[(2S)-2-hydroxy-2-phenylethyl]cyclopentanecarboxamide
CID 93032915
N-[(2S)-2-(3-methylphenyl)propyl]-2-piperidin-4-ylacetamide
CID 124689334
(Z)-N-[2-hydroxy-2-(3-methylphenyl)ethyl]-2,3-dimethylpent-2-enamide
CID 110025962
N-[2-(4-fluoro-3-methylphenyl)-2-hydroxyethyl]cyclopropanecarboxamide
CID 82116875

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide?
The IUPAC name of N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide (CID 110012074) is N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide is Cc1cccc(C(O)CNC(=O)C2CCNCC2)c1.
What is the InChIKey of N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide?
The InChIKey is QLFDJVDSLCJONX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-3-2-4-13(9-11)14(18)10-17-15(19)12-5-7-16-8-6-12/h2-4,9,12,14,16,18H,5-8,10H2,1H3,(H,17,19).
What are the key properties of N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide?
N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.14, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-2-(3-methylphenyl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 110012074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).