N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine

C30H25N5O — CID 67416890

IUPACN-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine
SMILESCOc1cc(Nc2cccn3c(-c4cccc(-c5ccccc5)c4)cnc23)ccc1-n1cnc(C)c1
InChIInChI=1S/C30H25N5O/c1-21-19-34(20-32-21)27-14-13-25(17-29(27)36-2)33-26-12-7-15-35-28(18-31-30(26)35)24-11-6-10-23(16-24)22-8-4-3-5-9-22/h3-20,33H,1-2H3
InChIKeyHIQJLTUQBXNQOR-UHFFFAOYSA-N
MW471.56 g/mol
LogP6.91
Rot. Bonds6

About N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine

N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine (PubChem CID 67416890) has the molecular formula C30H25N5O and a molecular weight of 471.56 g/mol. Its IUPAC name is N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine.

Molecular Properties

Compound NameN-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine
PubChem CID67416890
Molecular FormulaC30H25N5O
Molecular Weight471.56 g/mol
Exact Mass471.21
IUPAC NameN-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine
SMILESCOc1cc(Nc2cccn3c(-c4cccc(-c5ccccc5)c4)cnc23)ccc1-n1cnc(C)c1
InChIInChI=1S/C30H25N5O/c1-21-19-34(20-32-21)27-14-13-25(17-29(27)36-2)33-26-12-7-15-35-28(18-31-30(26)35)24-11-6-10-23(16-24)22-8-4-3-5-9-22/h3-20,33H,1-2H3
InChIKeyHIQJLTUQBXNQOR-UHFFFAOYSA-N
XLogP6.91
TPSA56.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.56
LogP ≤ 56.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine?
The IUPAC name of N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine (CID 67416890) is N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine.
What is the SMILES notation for N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine?
The canonical SMILES for N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine is COc1cc(Nc2cccn3c(-c4cccc(-c5ccccc5)c4)cnc23)ccc1-n1cnc(C)c1.
What is the InChIKey of N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine?
The InChIKey is HIQJLTUQBXNQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25N5O/c1-21-19-34(20-32-21)27-14-13-25(17-29(27)36-2)33-26-12-7-15-35-28(18-31-30(26)35)24-11-6-10-23(16-24)22-8-4-3-5-9-22/h3-20,33H,1-2H3.
What are the key properties of N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine?
N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine has a molecular weight of 471.56 g/mol, XLogP of 6.91, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-3-(3-phenylphenyl)imidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 67416890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).