2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide

C19H19ClN4O — CID 118697357

IUPAC2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide
SMILESCc1ccc2nc(NC(=O)Cc3cccc(Cl)c3)n(C3CCC3)c2n1
InChIInChI=1S/C19H19ClN4O/c1-12-8-9-16-18(21-12)24(15-6-3-7-15)19(22-16)23-17(25)11-13-4-2-5-14(20)10-13/h2,4-5,8-10,15H,3,6-7,11H2,1H3,(H,22,23,25)
InChIKeyONSXZQUOOGSGKF-UHFFFAOYSA-N
MW354.84 g/mol
LogP4.30
Rot. Bonds4

About 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide

2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide (PubChem CID 118697357) has the molecular formula C19H19ClN4O and a molecular weight of 354.84 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide
PubChem CID118697357
Molecular FormulaC19H19ClN4O
Molecular Weight354.84 g/mol
Exact Mass354.12
IUPAC Name2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide
SMILESCc1ccc2nc(NC(=O)Cc3cccc(Cl)c3)n(C3CCC3)c2n1
InChIInChI=1S/C19H19ClN4O/c1-12-8-9-16-18(21-12)24(15-6-3-7-15)19(22-16)23-17(25)11-13-4-2-5-14(20)10-13/h2,4-5,8-10,15H,3,6-7,11H2,1H3,(H,22,23,25)
InChIKeyONSXZQUOOGSGKF-UHFFFAOYSA-N
XLogP4.30
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.84
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide (CID 118697357) is 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide is Cc1ccc2nc(NC(=O)Cc3cccc(Cl)c3)n(C3CCC3)c2n1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide?
The InChIKey is ONSXZQUOOGSGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O/c1-12-8-9-16-18(21-12)24(15-6-3-7-15)19(22-16)23-17(25)11-13-4-2-5-14(20)10-13/h2,4-5,8-10,15H,3,6-7,11H2,1H3,(H,22,23,25).
What are the key properties of 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide?
2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide has a molecular weight of 354.84 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)acetamide is sourced from PubChem (CID 118697357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).