6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine

C18H16BrN5O — CID 154620336

IUPAC6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(Nc2c(-c3cnc(C)[nH]3)nc3ccc(Br)cn23)cc1
InChIInChI=1S/C18H16BrN5O/c1-11-20-9-15(21-11)17-18(22-13-4-6-14(25-2)7-5-13)24-10-12(19)3-8-16(24)23-17/h3-10,22H,1-2H3,(H,20,21)
InChIKeyGAKPVJVECQSDAO-UHFFFAOYSA-N
MW398.26 g/mol
LogP4.55
Rot. Bonds4

About 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine

6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 154620336) has the molecular formula C18H16BrN5O and a molecular weight of 398.26 g/mol. Its IUPAC name is 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine
PubChem CID154620336
Molecular FormulaC18H16BrN5O
Molecular Weight398.26 g/mol
Exact Mass397.05
IUPAC Name6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(Nc2c(-c3cnc(C)[nH]3)nc3ccc(Br)cn23)cc1
InChIInChI=1S/C18H16BrN5O/c1-11-20-9-15(21-11)17-18(22-13-4-6-14(25-2)7-5-13)24-10-12(19)3-8-16(24)23-17/h3-10,22H,1-2H3,(H,20,21)
InChIKeyGAKPVJVECQSDAO-UHFFFAOYSA-N
XLogP4.55
TPSA67.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.26
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine with MolForge

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

Launch Full Analysis

Related Compounds

9-cyclopentyl-N(8)-(2-fluorophenyl)-N(2)-(4-methoxyphenyl)-9H-purine-2,8-diamine
CID 11647397
3-(4-methoxyphenyl)-~{N}-[(3~{R})-1-pyridin-4-ylpyrrolidin-3-yl]-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine
CID 86278982
6-methoxy-2-pyridin-2-yl-1H-benzimidazole
CID 186762
N-(4-methoxyphenyl)-1-methyl-1H-imidazo[4,5-c]pyridin-4-amine
CID 15266433
6-[4-(4-methoxyphenyl)piperazin-1-yl]-7H-purine
CID 756705
5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-
CID 5748926
6-Bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo[1,2-a]pyridine
CID 11574902
8-Bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]-6-methylimidazo[1,2-a]pyridine
CID 11661609
9-(4-Methoxyphenyl)-9h-purine-2,6-diamine
CID 240288
5-methoxy-2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridine
CID 10192988
2-[2-(4-methoxypyridin-2-yl)ethyl]-6-bromo-3H-imidazo[4,5-b]pyridine
CID 10308710
8-N-(2-fluorophenyl)-2-N-(4-methoxyphenyl)-9-phenylpurine-2,8-diamine
CID 24810995

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine (CID 154620336) is 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine is COc1ccc(Nc2c(-c3cnc(C)[nH]3)nc3ccc(Br)cn23)cc1.
What is the InChIKey of 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is GAKPVJVECQSDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16BrN5O/c1-11-20-9-15(21-11)17-18(22-13-4-6-14(25-2)7-5-13)24-10-12(19)3-8-16(24)23-17/h3-10,22H,1-2H3,(H,20,21).
What are the key properties of 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine?
6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 398.26 g/mol, XLogP of 4.55, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(4-methoxyphenyl)-2-(2-methyl-1H-imidazol-5-yl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 154620336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).