2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide

C18H17ClN4O2 — CID 155561323

IUPAC2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCCNC(=O)c1c(NC(=O)c2cccc(Cl)c2)nc2ccccn12
InChIInChI=1S/C18H17ClN4O2/c1-2-9-20-18(25)15-16(21-14-8-3-4-10-23(14)15)22-17(24)12-6-5-7-13(19)11-12/h3-8,10-11H,2,9H2,1H3,(H,20,25)(H,22,24)
InChIKeyKKJKUQXLIMACIH-UHFFFAOYSA-N
MW356.81 g/mol
LogP3.38
Rot. Bonds5

About 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide

2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 155561323) has the molecular formula C18H17ClN4O2 and a molecular weight of 356.81 g/mol. Its IUPAC name is 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID155561323
Molecular FormulaC18H17ClN4O2
Molecular Weight356.81 g/mol
Exact Mass356.10
IUPAC Name2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCCNC(=O)c1c(NC(=O)c2cccc(Cl)c2)nc2ccccn12
InChIInChI=1S/C18H17ClN4O2/c1-2-9-20-18(25)15-16(21-14-8-3-4-10-23(14)15)22-17(24)12-6-5-7-13(19)11-12/h3-8,10-11H,2,9H2,1H3,(H,20,25)(H,22,24)
InChIKeyKKJKUQXLIMACIH-UHFFFAOYSA-N
XLogP3.38
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide (CID 155561323) is 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide is CCCNC(=O)c1c(NC(=O)c2cccc(Cl)c2)nc2ccccn12.
What is the InChIKey of 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is KKJKUQXLIMACIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O2/c1-2-9-20-18(25)15-16(21-14-8-3-4-10-23(14)15)22-17(24)12-6-5-7-13(19)11-12/h3-8,10-11H,2,9H2,1H3,(H,20,25)(H,22,24).
What are the key properties of 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide?
2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 356.81 g/mol, XLogP of 3.38, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorobenzoyl)amino]-N-propylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 155561323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).