N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide

C17H17N3O — CID 110704451

IUPACN-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2cccn3ccnc23)cc1
InChIInChI=1S/C17H17N3O/c1-12(2)13-5-7-14(8-6-13)19-17(21)15-4-3-10-20-11-9-18-16(15)20/h3-12H,1-2H3,(H,19,21)
InChIKeyGKIUNDRYYMECHT-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.71
Rot. Bonds3

About N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide

N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide (PubChem CID 110704451) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide
PubChem CID110704451
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC NameN-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2cccn3ccnc23)cc1
InChIInChI=1S/C17H17N3O/c1-12(2)13-5-7-14(8-6-13)19-17(21)15-4-3-10-20-11-9-18-16(15)20/h3-12H,1-2H3,(H,19,21)
InChIKeyGKIUNDRYYMECHT-UHFFFAOYSA-N
XLogP3.71
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide?
The IUPAC name of N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide (CID 110704451) is N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide.
What is the SMILES notation for N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide?
The canonical SMILES for N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide is CC(C)c1ccc(NC(=O)c2cccn3ccnc23)cc1.
What is the InChIKey of N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide?
The InChIKey is GKIUNDRYYMECHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-12(2)13-5-7-14(8-6-13)19-17(21)15-4-3-10-20-11-9-18-16(15)20/h3-12H,1-2H3,(H,19,21).
What are the key properties of N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide?
N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine-8-carboxamide is sourced from PubChem (CID 110704451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).