2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine

C20H19N3O — CID 4130595

IUPAC2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCC(C)c1ccc(Nc2c(-c3ccco3)nc3ccccn23)cc1
InChIInChI=1S/C20H19N3O/c1-14(2)15-8-10-16(11-9-15)21-20-19(17-6-5-13-24-17)22-18-7-3-4-12-23(18)20/h3-14,21H,1-2H3
InChIKeyALYCZDVRLDFRHR-UHFFFAOYSA-N
MW317.39 g/mol
LogP5.46
Rot. Bonds4

About 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine

2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 4130595) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID4130595
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC Name2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCC(C)c1ccc(Nc2c(-c3ccco3)nc3ccccn23)cc1
InChIInChI=1S/C20H19N3O/c1-14(2)15-8-10-16(11-9-15)21-20-19(17-6-5-13-24-17)22-18-7-3-4-12-23(18)20/h3-14,21H,1-2H3
InChIKeyALYCZDVRLDFRHR-UHFFFAOYSA-N
XLogP5.46
TPSA42.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500317.39
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_65_C(6)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine (CID 4130595) is 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine is CC(C)c1ccc(Nc2c(-c3ccco3)nc3ccccn23)cc1.
What is the InChIKey of 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is ALYCZDVRLDFRHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-14(2)15-8-10-16(11-9-15)21-20-19(17-6-5-13-24-17)22-18-7-3-4-12-23(18)20/h3-14,21H,1-2H3.
What are the key properties of 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine?
2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 317.39 g/mol, XLogP of 5.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 4130595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).