2-fluoro-4-methyl-3-pyridin-3-ylbenzamide

C13H11FN2O — CID 155144897

IUPAC2-fluoro-4-methyl-3-pyridin-3-ylbenzamide
SMILESCc1ccc(C(N)=O)c(F)c1-c1cccnc1
InChIInChI=1S/C13H11FN2O/c1-8-4-5-10(13(15)17)12(14)11(8)9-3-2-6-16-7-9/h2-7H,1H3,(H2,15,17)
InChIKeyPWDLKEZDTIGTPE-UHFFFAOYSA-N
MW230.24 g/mol
LogP2.30
Rot. Bonds2

About 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide

2-fluoro-4-methyl-3-pyridin-3-ylbenzamide (PubChem CID 155144897) has the molecular formula C13H11FN2O and a molecular weight of 230.24 g/mol. Its IUPAC name is 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-fluoro-4-methyl-3-pyridin-3-ylbenzamide
PubChem CID155144897
Molecular FormulaC13H11FN2O
Molecular Weight230.24 g/mol
Exact Mass230.09
IUPAC Name2-fluoro-4-methyl-3-pyridin-3-ylbenzamide
SMILESCc1ccc(C(N)=O)c(F)c1-c1cccnc1
InChIInChI=1S/C13H11FN2O/c1-8-4-5-10(13(15)17)12(14)11(8)9-3-2-6-16-7-9/h2-7H,1H3,(H2,15,17)
InChIKeyPWDLKEZDTIGTPE-UHFFFAOYSA-N
XLogP2.30
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-2-pyridin-3-ylbenzene-1,3-dicarboxylic acid
CID 151934643
3-fluoro-2,4-dimethylbenzamide
CID 119006165
3-methyl-2-pyridin-3-ylbenzoic acid
CID 46317094
5-methyl-6-pyridin-3-ylpyridine-2-carboxamide
CID 175790528
methyl 2,3,5,6-tetrafluoro-4-pyridin-3-ylbenzoate
CID 46317647
1-(2-methyl-4-pyridin-3-ylphenyl)ethanone
CID 20716212
3-methyl-2-pyridin-3-ylaniline
CID 22482419
2-ethoxy-4-pyridin-3-ylbenzamide
CID 155568101
2-(2-carbamoyl-5-pyridin-3-ylphenyl)propanoic acid
CID 90916200
3-pyridin-3-ylbenzamide;hydrochloride
CID 175813431
6-(2,6-difluoro-3-methoxyphenyl)-5-fluoro-3-pyridin-3-ylpyridine-2-carboxamide
CID 90286161
4-amino-6-methyl-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 116648034

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide?
The IUPAC name of 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide (CID 155144897) is 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide?
The canonical SMILES for 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide is Cc1ccc(C(N)=O)c(F)c1-c1cccnc1.
What is the InChIKey of 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide?
The InChIKey is PWDLKEZDTIGTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O/c1-8-4-5-10(13(15)17)12(14)11(8)9-3-2-6-16-7-9/h2-7H,1H3,(H2,15,17).
What are the key properties of 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide?
2-fluoro-4-methyl-3-pyridin-3-ylbenzamide has a molecular weight of 230.24 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-3-pyridin-3-ylbenzamide is sourced from PubChem (CID 155144897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).