2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide

C18H18N4O2 — CID 649714

IUPAC2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(NC(=O)c2c(C)nc3ccccn23)cc1
InChIInChI=1S/C18H18N4O2/c1-3-16(23)20-13-7-9-14(10-8-13)21-18(24)17-12(2)19-15-6-4-5-11-22(15)17/h4-11H,3H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyYCHSNCZCDDQUTG-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.24
Rot. Bonds4

About 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide

2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 649714) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID649714
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(NC(=O)c2c(C)nc3ccccn23)cc1
InChIInChI=1S/C18H18N4O2/c1-3-16(23)20-13-7-9-14(10-8-13)21-18(24)17-12(2)19-15-6-4-5-11-22(15)17/h4-11H,3H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyYCHSNCZCDDQUTG-UHFFFAOYSA-N
XLogP3.24
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 649714) is 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide is CCC(=O)Nc1ccc(NC(=O)c2c(C)nc3ccccn23)cc1.
What is the InChIKey of 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is YCHSNCZCDDQUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-3-16(23)20-13-7-9-14(10-8-13)21-18(24)17-12(2)19-15-6-4-5-11-22(15)17/h4-11H,3H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 649714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).