2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine

C24H24N4 — CID 123220669

IUPAC2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine
SMILESCNc1ccn2c(-c3ccccc3)c(-c3ccc(C4(N)CCC4)cc3)nc2c1
InChIInChI=1S/C24H24N4/c1-26-20-12-15-28-21(16-20)27-22(23(28)18-6-3-2-4-7-18)17-8-10-19(11-9-17)24(25)13-5-14-24/h2-4,6-12,15-16,26H,5,13-14,25H2,1H3
InChIKeySTSCAVJMTYMKJO-UHFFFAOYSA-N
MW368.48 g/mol
LogP5.05
Rot. Bonds4

About 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine

2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine (PubChem CID 123220669) has the molecular formula C24H24N4 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine.

Molecular Properties

Compound Name2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine
PubChem CID123220669
Molecular FormulaC24H24N4
Molecular Weight368.48 g/mol
Exact Mass368.20
IUPAC Name2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine
SMILESCNc1ccn2c(-c3ccccc3)c(-c3ccc(C4(N)CCC4)cc3)nc2c1
InChIInChI=1S/C24H24N4/c1-26-20-12-15-28-21(16-20)27-22(23(28)18-6-3-2-4-7-18)17-8-10-19(11-9-17)24(25)13-5-14-24/h2-4,6-12,15-16,26H,5,13-14,25H2,1H3
InChIKeySTSCAVJMTYMKJO-UHFFFAOYSA-N
XLogP5.05
TPSA55.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.48
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine?
The IUPAC name of 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine (CID 123220669) is 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine.
What is the SMILES notation for 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine?
The canonical SMILES for 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine is CNc1ccn2c(-c3ccccc3)c(-c3ccc(C4(N)CCC4)cc3)nc2c1.
What is the InChIKey of 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine?
The InChIKey is STSCAVJMTYMKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4/c1-26-20-12-15-28-21(16-20)27-22(23(28)18-6-3-2-4-7-18)17-8-10-19(11-9-17)24(25)13-5-14-24/h2-4,6-12,15-16,26H,5,13-14,25H2,1H3.
What are the key properties of 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine?
2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine has a molecular weight of 368.48 g/mol, XLogP of 5.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-aminocyclobutyl)phenyl]-N-methyl-3-phenylimidazo[1,2-a]pyridin-7-amine is sourced from PubChem (CID 123220669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).