1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine

C24H23N3 — CID 66665667

IUPAC1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine
SMILESCc1cccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n12
InChIInChI=1S/C24H23N3/c1-17-7-5-10-21-26-22(23(27(17)21)19-8-3-2-4-9-19)18-11-13-20(14-12-18)24(25)15-6-16-24/h2-5,7-14H,6,15-16,25H2,1H3
InChIKeyAQQGZTUNRJVZAQ-UHFFFAOYSA-N
MW353.47 g/mol
LogP5.31
Rot. Bonds3

About 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine

1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine (PubChem CID 66665667) has the molecular formula C24H23N3 and a molecular weight of 353.47 g/mol. Its IUPAC name is 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine.

Molecular Properties

Compound Name1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine
PubChem CID66665667
Molecular FormulaC24H23N3
Molecular Weight353.47 g/mol
Exact Mass353.19
IUPAC Name1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine
SMILESCc1cccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n12
InChIInChI=1S/C24H23N3/c1-17-7-5-10-21-26-22(23(27(17)21)19-8-3-2-4-9-19)18-11-13-20(14-12-18)24(25)15-6-16-24/h2-5,7-14H,6,15-16,25H2,1H3
InChIKeyAQQGZTUNRJVZAQ-UHFFFAOYSA-N
XLogP5.31
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.47
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine?
The IUPAC name of 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine (CID 66665667) is 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine.
What is the SMILES notation for 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine?
The canonical SMILES for 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine is Cc1cccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n12.
What is the InChIKey of 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine?
The InChIKey is AQQGZTUNRJVZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3/c1-17-7-5-10-21-26-22(23(27(17)21)19-8-3-2-4-9-19)18-11-13-20(14-12-18)24(25)15-6-16-24/h2-5,7-14H,6,15-16,25H2,1H3.
What are the key properties of 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine?
1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine has a molecular weight of 353.47 g/mol, XLogP of 5.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(5-methyl-3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclobutan-1-amine is sourced from PubChem (CID 66665667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).