N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide

C15H11ClFN3O3S — CID 47779560

IUPACN-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCS(=O)(=O)c1nc(C(=O)Nc2ccc(Cl)cc2F)c2ccccn12
InChIInChI=1S/C15H11ClFN3O3S/c1-24(22,23)15-19-13(12-4-2-3-7-20(12)15)14(21)18-11-6-5-9(16)8-10(11)17/h2-8H,1H3,(H,18,21)
InChIKeyHCYPPDAXWKRSAO-UHFFFAOYSA-N
MW367.79 g/mol
LogP2.78
Rot. Bonds3

About N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide

N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 47779560) has the molecular formula C15H11ClFN3O3S and a molecular weight of 367.79 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID47779560
Molecular FormulaC15H11ClFN3O3S
Molecular Weight367.79 g/mol
Exact Mass367.02
IUPAC NameN-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCS(=O)(=O)c1nc(C(=O)Nc2ccc(Cl)cc2F)c2ccccn12
InChIInChI=1S/C15H11ClFN3O3S/c1-24(22,23)15-19-13(12-4-2-3-7-20(12)15)14(21)18-11-6-5-9(16)8-10(11)17/h2-8H,1H3,(H,18,21)
InChIKeyHCYPPDAXWKRSAO-UHFFFAOYSA-N
XLogP2.78
TPSA80.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.79
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119384120
2,2,2-trifluoro-1-(3-methylsulfonylimidazo[1,5-a]pyridin-1-yl)ethanone
CID 12617475
3-methylsulfonyl-N-prop-2-ynylimidazo[1,5-a]pyridine-1-carboxamide
CID 47401298
N-(3-aminopropyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119407322
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 51094701
N-[2-(methylamino)propyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 120832749
N-[3-(methylamino)propyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119432312
N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119477193
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 60585999
1-N-(2,4-dichlorophenyl)-3-N-propylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066150
N-[2-(benzylamino)-2-oxoethyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 47783322
1-N-(2,5-dichlorophenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066464

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide (CID 47779560) is N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide is CS(=O)(=O)c1nc(C(=O)Nc2ccc(Cl)cc2F)c2ccccn12.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is HCYPPDAXWKRSAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFN3O3S/c1-24(22,23)15-19-13(12-4-2-3-7-20(12)15)14(21)18-11-6-5-9(16)8-10(11)17/h2-8H,1H3,(H,18,21).
What are the key properties of N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide?
N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 367.79 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-fluorophenyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 47779560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).