2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide

C13H16F2N2O — CID 60806728

IUPAC2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide
SMILESCN(C(=O)c1c(F)cccc1F)C1CCCNC1
InChIInChI=1S/C13H16F2N2O/c1-17(9-4-3-7-16-8-9)13(18)12-10(14)5-2-6-11(12)15/h2,5-6,9,16H,3-4,7-8H2,1H3
InChIKeyUYCHMAVIBCJYNR-UHFFFAOYSA-N
MW254.28 g/mol
LogP1.79
Rot. Bonds2

About 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide

2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide (PubChem CID 60806728) has the molecular formula C13H16F2N2O and a molecular weight of 254.28 g/mol. Its IUPAC name is 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide.

Molecular Properties

Compound Name2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide
PubChem CID60806728
Molecular FormulaC13H16F2N2O
Molecular Weight254.28 g/mol
Exact Mass254.12
IUPAC Name2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide
SMILESCN(C(=O)c1c(F)cccc1F)C1CCCNC1
InChIInChI=1S/C13H16F2N2O/c1-17(9-4-3-7-16-8-9)13(18)12-10(14)5-2-6-11(12)15/h2,5-6,9,16H,3-4,7-8H2,1H3
InChIKeyUYCHMAVIBCJYNR-UHFFFAOYSA-N
XLogP1.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.28
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azepan-4-yl)-2-fluoro-6-methoxy-N-methylbenzamide
CID 107172410
2,6-difluoro-N,3-dimethyl-N-pyrrolidin-3-ylbenzamide
CID 82815007
3-fluoro-N,4-dimethyl-N-piperidin-3-ylbenzamide
CID 60807217
2,3-difluoro-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554382
N,2,3-trimethyl-N-piperidin-3-ylbenzamide
CID 54923746
N,3-dimethyl-N-piperidin-3-ylbenzamide
CID 60807215
3-fluoro-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 60805996
5-fluoro-N,2-dimethyl-N-piperidin-3-ylbenzamide
CID 55228435
N-methyl-N-piperidin-3-yl-1,2-oxazole-5-carboxamide
CID 63643873
5-fluoro-N-methyl-N-piperidin-3-ylpyridine-3-carboxamide
CID 104786200
2-bromo-4-fluoro-N-methyl-N-piperidin-3-ylbenzamide
CID 63641753
2,6-difluoro-N-methyl-N-(4-oxocyclohexyl)benzamide
CID 79120460

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide?
The IUPAC name of 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide (CID 60806728) is 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide.
What is the SMILES notation for 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide?
The canonical SMILES for 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide is CN(C(=O)c1c(F)cccc1F)C1CCCNC1.
What is the InChIKey of 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide?
The InChIKey is UYCHMAVIBCJYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O/c1-17(9-4-3-7-16-8-9)13(18)12-10(14)5-2-6-11(12)15/h2,5-6,9,16H,3-4,7-8H2,1H3.
What are the key properties of 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide?
2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide has a molecular weight of 254.28 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide is sourced from PubChem (CID 60806728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).