N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide

C19H18ClN3O — CID 166222363

IUPACN-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide
SMILESCc1c(C(=O)NC2CC(c3ccc(Cl)cc3)C2)ccc2cncn12
InChIInChI=1S/C19H18ClN3O/c1-12-18(7-6-17-10-21-11-23(12)17)19(24)22-16-8-14(9-16)13-2-4-15(20)5-3-13/h2-7,10-11,14,16H,8-9H2,1H3,(H,22,24)
InChIKeyROTJLHIIXJXFCU-UHFFFAOYSA-N
MW339.83 g/mol
LogP3.97
Rot. Bonds3

About N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide

N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide (PubChem CID 166222363) has the molecular formula C19H18ClN3O and a molecular weight of 339.83 g/mol. Its IUPAC name is N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide
PubChem CID166222363
Molecular FormulaC19H18ClN3O
Molecular Weight339.83 g/mol
Exact Mass339.11
IUPAC NameN-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide
SMILESCc1c(C(=O)NC2CC(c3ccc(Cl)cc3)C2)ccc2cncn12
InChIInChI=1S/C19H18ClN3O/c1-12-18(7-6-17-10-21-11-23(12)17)19(24)22-16-8-14(9-16)13-2-4-15(20)5-3-13/h2-7,10-11,14,16H,8-9H2,1H3,(H,22,24)
InChIKeyROTJLHIIXJXFCU-UHFFFAOYSA-N
XLogP3.97
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.83
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide (CID 166222363) is N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide is Cc1c(C(=O)NC2CC(c3ccc(Cl)cc3)C2)ccc2cncn12.
What is the InChIKey of N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide?
The InChIKey is ROTJLHIIXJXFCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O/c1-12-18(7-6-17-10-21-11-23(12)17)19(24)22-16-8-14(9-16)13-2-4-15(20)5-3-13/h2-7,10-11,14,16H,8-9H2,1H3,(H,22,24).
What are the key properties of N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide?
N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide has a molecular weight of 339.83 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-chlorophenyl)cyclobutyl]-5-methylimidazo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 166222363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).