N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride

C13H18ClFN2O — CID 119264146

IUPACN-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride
SMILESCc1ccc(F)c(NC(=O)C2CCCNC2)c1.Cl
InChIInChI=1S/C13H17FN2O.ClH/c1-9-4-5-11(14)12(7-9)16-13(17)10-3-2-6-15-8-10;/h4-5,7,10,15H,2-3,6,8H2,1H3,(H,16,17);1H
InChIKeyGLFYZRSXAOPBKH-UHFFFAOYSA-N
MW272.75 g/mol
LogP2.49
Rot. Bonds2

About N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride

N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119264146) has the molecular formula C13H18ClFN2O and a molecular weight of 272.75 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119264146
Molecular FormulaC13H18ClFN2O
Molecular Weight272.75 g/mol
Exact Mass272.11
IUPAC NameN-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride
SMILESCc1ccc(F)c(NC(=O)C2CCCNC2)c1.Cl
InChIInChI=1S/C13H17FN2O.ClH/c1-9-4-5-11(14)12(7-9)16-13(17)10-3-2-6-15-8-10;/h4-5,7,10,15H,2-3,6,8H2,1H3,(H,16,17);1H
InChIKeyGLFYZRSXAOPBKH-UHFFFAOYSA-N
XLogP2.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.75
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluoro-4-methylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119263786
(3S)-N-(5-chloro-2-fluorophenyl)piperidine-3-carboxamide
CID 81124041
N-(2-chloro-4-methylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119262654
N-[2-[(dimethylamino)methyl]-4-methylphenyl]piperidine-3-carboxamide;dihydrochloride
CID 119887720
N-(5-chloro-2-fluorophenyl)pyrrolidine-3-carboxamide
CID 63007340
N-(2,4,5-trifluorophenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119708623
N-(5-fluoro-2,4-dimethoxyphenyl)piperidine-3-carboxamide
CID 119336082
N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide
CID 79050344
(3S)-N-(2,3,5-trifluorophenyl)piperidine-3-carboxamide
CID 81139845
N-(3-bromo-4-fluorophenyl)piperidine-3-carboxamide;hydrochloride
CID 119281108
methyl 4-fluoro-3-(pyrrolidine-3-carbonylamino)benzoate
CID 63007212
N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-3-carboxamide;hydrochloride
CID 119263430

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride (CID 119264146) is N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride is Cc1ccc(F)c(NC(=O)C2CCCNC2)c1.Cl.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is GLFYZRSXAOPBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O.ClH/c1-9-4-5-11(14)12(7-9)16-13(17)10-3-2-6-15-8-10;/h4-5,7,10,15H,2-3,6,8H2,1H3,(H,16,17);1H.
What are the key properties of N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride?
N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 272.75 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119264146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).