N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide

C14H18F2N2O — CID 82819007

IUPACN-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide
SMILESCc1ccc(F)c(NC(=O)C2NCCCC2C)c1F
InChIInChI=1S/C14H18F2N2O/c1-8-5-6-10(15)13(11(8)16)18-14(19)12-9(2)4-3-7-17-12/h5-6,9,12,17H,3-4,7H2,1-2H3,(H,18,19)
InChIKeyFDKWOONMGDFQSW-UHFFFAOYSA-N
MW268.31 g/mol
LogP2.60
Rot. Bonds2

About N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide

N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide (PubChem CID 82819007) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide
PubChem CID82819007
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC NameN-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide
SMILESCc1ccc(F)c(NC(=O)C2NCCCC2C)c1F
InChIInChI=1S/C14H18F2N2O/c1-8-5-6-10(15)13(11(8)16)18-14(19)12-9(2)4-3-7-17-12/h5-6,9,12,17H,3-4,7H2,1-2H3,(H,18,19)
InChIKeyFDKWOONMGDFQSW-UHFFFAOYSA-N
XLogP2.60
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-(2,3,5,6-tetrafluorophenyl)piperidine-2-carboxamide
CID 107641806
3-methyl-N-(2,4,6-trimethylphenyl)piperidine-2-carboxamide
CID 62340619
N-(4-fluoro-2-methylphenyl)-3-methylpiperidine-2-carboxamide
CID 62339106
N-(3-bromo-4-fluorophenyl)-3-methylpiperidine-2-carboxamide
CID 107068566
4-fluoro-3-[(3-methylpiperidine-2-carbonyl)amino]benzoic acid
CID 107067490
N-(5-iodo-2-methylphenyl)-3-methylpiperidine-2-carboxamide
CID 114257371
N-(3-carbamoyl-4-fluorophenyl)-3-methylpiperidine-2-carboxamide
CID 107067383
3-methyl-N-(2,3,4,5,6-pentafluorophenyl)pyrrolidine-2-carboxamide
CID 102779885
3-methyl-N-(2,4,6-trifluorophenyl)pyrrolidine-2-carboxamide
CID 102779633
N-(3-chloro-5-fluorophenyl)-3-methylpiperidine-2-carboxamide
CID 107365880
N-(2-bromo-3-methylphenyl)-3-methylpiperidine-2-carboxamide
CID 107068466
N-(4-chloro-2-iodophenyl)-3-methylpiperidine-2-carboxamide
CID 107625589

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide?
The IUPAC name of N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide (CID 82819007) is N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide is Cc1ccc(F)c(NC(=O)C2NCCCC2C)c1F.
What is the InChIKey of N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide?
The InChIKey is FDKWOONMGDFQSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-8-5-6-10(15)13(11(8)16)18-14(19)12-9(2)4-3-7-17-12/h5-6,9,12,17H,3-4,7H2,1-2H3,(H,18,19).
What are the key properties of N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide?
N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide has a molecular weight of 268.31 g/mol, XLogP of 2.60, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide is sourced from PubChem (CID 82819007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).