(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride

C13H19ClN2O — CID 119670939

IUPAC(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)[C@H]2CCCCN2)cc1.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-10-5-7-11(8-6-10)15-13(16)12-4-2-3-9-14-12;/h5-8,12,14H,2-4,9H2,1H3,(H,15,16);1H/t12-;/m1./s1
InChIKeyAEFWYYJXDSZTPQ-UTONKHPSSA-N
MW254.76 g/mol
LogP2.50
Rot. Bonds2

About (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride

(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119670939) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
PubChem CID119670939
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC Name(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)[C@H]2CCCCN2)cc1.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-10-5-7-11(8-6-10)15-13(16)12-4-2-3-9-14-12;/h5-8,12,14H,2-4,9H2,1H3,(H,15,16);1H/t12-;/m1./s1
InChIKeyAEFWYYJXDSZTPQ-UTONKHPSSA-N
XLogP2.50
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(4-methoxyphenyl)piperidine-2-carboxamide;hydrochloride
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CID 103808067
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(2R)-N-[4-(dimethylcarbamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119684891
(2R)-N-pyridin-4-ylpiperidine-2-carboxamide;dihydrochloride
CID 119827101
(2S)-N-(3,5-dimethylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 67505940
N-[4-(propan-2-ylcarbamoylamino)phenyl]piperidine-2-carboxamide
CID 119279232
(2S)-N-[4-(3-methylbutanoylamino)phenyl]piperidine-2-carboxamide;hydrochloride
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N-(4-tert-butylsulfanylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119315492

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride (CID 119670939) is (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride is Cc1ccc(NC(=O)[C@H]2CCCCN2)cc1.Cl.
What is the InChIKey of (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is AEFWYYJXDSZTPQ-UTONKHPSSA-N. The full InChI is InChI=1S/C13H18N2O.ClH/c1-10-5-7-11(8-6-10)15-13(16)12-4-2-3-9-14-12;/h5-8,12,14H,2-4,9H2,1H3,(H,15,16);1H/t12-;/m1./s1.
What are the key properties of (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride?
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 254.76 g/mol, XLogP of 2.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119670939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).