2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide

C13H10F2N2O — CID 9414595

IUPAC2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1ccc(F)cc1F
InChIInChI=1S/C13H10F2N2O/c14-9-4-5-11(12(15)7-9)13(18)17-8-10-3-1-2-6-16-10/h1-7H,8H2,(H,17,18)
InChIKeyCVTIAKJMIBPYLD-UHFFFAOYSA-N
MW248.23 g/mol
LogP2.29
Rot. Bonds3

About 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide

2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 9414595) has the molecular formula C13H10F2N2O and a molecular weight of 248.23 g/mol. Its IUPAC name is 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide
PubChem CID9414595
Molecular FormulaC13H10F2N2O
Molecular Weight248.23 g/mol
Exact Mass248.08
IUPAC Name2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1ccc(F)cc1F
InChIInChI=1S/C13H10F2N2O/c14-9-4-5-11(12(15)7-9)13(18)17-8-10-3-1-2-6-16-10/h1-7H,8H2,(H,17,18)
InChIKeyCVTIAKJMIBPYLD-UHFFFAOYSA-N
XLogP2.29
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.23
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-difluoro-N-(2-pyridin-2-ylethyl)benzamide
CID 51164132
2-amino-5-fluoro-N-(pyridin-2-ylmethyl)benzamide
CID 43132619
2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide
CID 51107830
2-(2,5-difluorophenyl)-2-oxo-N-(pyridin-2-ylmethyl)acetamide
CID 94285001
2-[(2,5-difluorophenyl)methyl]-5-fluoro-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 23114730
2-(2,4-difluorophenyl)-1-oxo-N-(pyridin-2-ylmethyl)isoquinoline-4-carboxamide
CID 23987423
2-fluoro-N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]benzamide
CID 4781382
2,4-difluoro-N-[(6-methylpyrimidin-4-yl)methyl]benzamide
CID 122263261
6-(4-fluorophenyl)-2-methyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 171132589
2-(2,4-difluoroanilino)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
CID 109307146
1-N-[(4-fluorophenyl)methyl]-3-N-(pyridin-2-ylmethyl)benzene-1,3-dicarboxamide
CID 109054659
3-fluoro-2-(methylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 62649935

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide (CID 9414595) is 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide is O=C(NCc1ccccn1)c1ccc(F)cc1F.
What is the InChIKey of 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is CVTIAKJMIBPYLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N2O/c14-9-4-5-11(12(15)7-9)13(18)17-8-10-3-1-2-6-16-10/h1-7H,8H2,(H,17,18).
What are the key properties of 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide?
2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 248.23 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 9414595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).