N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide

C13H16F2N2O — CID 55177937

IUPACN-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)Nc2c(F)cccc2F)CCNCC1
InChIInChI=1S/C13H16F2N2O/c1-13(5-7-16-8-6-13)12(18)17-11-9(14)3-2-4-10(11)15/h2-4,16H,5-8H2,1H3,(H,17,18)
InChIKeyFDQZTKKSXUXYGM-UHFFFAOYSA-N
MW254.28 g/mol
LogP2.29
Rot. Bonds2

About N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide

N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide (PubChem CID 55177937) has the molecular formula C13H16F2N2O and a molecular weight of 254.28 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide
PubChem CID55177937
Molecular FormulaC13H16F2N2O
Molecular Weight254.28 g/mol
Exact Mass254.12
IUPAC NameN-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)Nc2c(F)cccc2F)CCNCC1
InChIInChI=1S/C13H16F2N2O/c1-13(5-7-16-8-6-13)12(18)17-11-9(14)3-2-4-10(11)15/h2-4,16H,5-8H2,1H3,(H,17,18)
InChIKeyFDQZTKKSXUXYGM-UHFFFAOYSA-N
XLogP2.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.28
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-(2,3,4,5,6-pentafluorophenyl)piperidine-4-carboxamide
CID 115564450
N-(2,6-difluorophenyl)-1,4-dimethylpiperidine-4-carboxamide
CID 134434682
N-(2,6-difluoro-3-methylphenyl)-3-methylpyrrolidine-3-carboxamide
CID 82818995
N-(4-chloro-2-fluorophenyl)-4-methylpiperidine-4-carboxamide
CID 63121680
N-[1-(2,6-difluorophenyl)ethyl]-4-methylpiperidine-4-carboxamide
CID 63122165
N-(4-bromo-2-fluorophenyl)-4-methylpiperidine-4-carboxamide
CID 63121522
4-methyl-N-(3,4,5-trifluorophenyl)piperidine-4-carboxamide
CID 55177366
N-(4-fluoro-2-methylphenyl)-4-methylpiperidine-4-carboxamide
CID 63121495
N-(3,4-dichloro-2-fluorophenyl)-4-methylpiperidine-4-carboxamide
CID 170264995
N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide
CID 67036908
N-(2-chloro-6-methylphenyl)-3-methylpyrrolidine-3-carboxamide
CID 66256845
4-methyl-N-(4-methylphenyl)piperidine-4-carboxamide
CID 63121506

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide (CID 55177937) is N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide is CC1(C(=O)Nc2c(F)cccc2F)CCNCC1.
What is the InChIKey of N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide?
The InChIKey is FDQZTKKSXUXYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O/c1-13(5-7-16-8-6-13)12(18)17-11-9(14)3-2-4-10(11)15/h2-4,16H,5-8H2,1H3,(H,17,18).
What are the key properties of N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide?
N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide has a molecular weight of 254.28 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide is sourced from PubChem (CID 55177937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).