2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide

C15H11ClFN3O — CID 112500579

IUPAC2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide
SMILESO=C(NCc1ncc2ccccn12)c1c(F)cccc1Cl
InChIInChI=1S/C15H11ClFN3O/c16-11-5-3-6-12(17)14(11)15(21)19-9-13-18-8-10-4-1-2-7-20(10)13/h1-8H,9H2,(H,19,21)
InChIKeyFVJUFIDGBNVOSY-UHFFFAOYSA-N
MW303.72 g/mol
LogP3.06
Rot. Bonds3

About 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide

2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide (PubChem CID 112500579) has the molecular formula C15H11ClFN3O and a molecular weight of 303.72 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide
PubChem CID112500579
Molecular FormulaC15H11ClFN3O
Molecular Weight303.72 g/mol
Exact Mass303.06
IUPAC Name2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide
SMILESO=C(NCc1ncc2ccccn12)c1c(F)cccc1Cl
InChIInChI=1S/C15H11ClFN3O/c16-11-5-3-6-12(17)14(11)15(21)19-9-13-18-8-10-4-1-2-7-20(10)13/h1-8H,9H2,(H,19,21)
InChIKeyFVJUFIDGBNVOSY-UHFFFAOYSA-N
XLogP3.06
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.72
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichlorophenoxy)-N-(imidazo[1,5-a]pyridin-3-ylmethyl)acetamide
CID 112500571
5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 81091399
N-[(2-chloro-6-fluorophenyl)methyl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 131889223
N-[2-[(2-chloro-6-fluorobenzoyl)amino]ethyl]pyrazine-2-carboxamide
CID 108542988
2-chloro-6-fluoro-N-[[1-(4-fluorophenyl)tetrazol-5-yl]methyl]benzamide
CID 18565796
2-chloro-6-fluoro-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
CID 14772555
2-bromo-6-fluoro-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)benzamide
CID 115678518
2-(2-fluorophenyl)-N-(imidazo[1,5-a]pyridin-3-ylmethyl)ethanesulfonamide
CID 110416171
2-chloro-N-[(3-chlorophenyl)methyl]-6-fluorobenzamide
CID 2679700
2-chloro-6-fluoro-N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]benzamide
CID 95986600
3-bromo-4-chloro-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)benzamide
CID 110630921
4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide
CID 110630905

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide (CID 112500579) is 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide is O=C(NCc1ncc2ccccn12)c1c(F)cccc1Cl.
What is the InChIKey of 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide?
The InChIKey is FVJUFIDGBNVOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFN3O/c16-11-5-3-6-12(17)14(11)15(21)19-9-13-18-8-10-4-1-2-7-20(10)13/h1-8H,9H2,(H,19,21).
What are the key properties of 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide?
2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide has a molecular weight of 303.72 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-(imidazo[1,5-a]pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 112500579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).