2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine

C21H19FN4O — CID 53301189

IUPAC2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine
SMILESCOc1ccc(Nc2c(-c3ccc(F)cc3)nc3nc(C)cc(C)n23)cc1
InChIInChI=1S/C21H19FN4O/c1-13-12-14(2)26-20(24-17-8-10-18(27-3)11-9-17)19(25-21(26)23-13)15-4-6-16(22)7-5-15/h4-12,24H,1-3H3
InChIKeyCDLQJUZZIBSLEZ-UHFFFAOYSA-N
MW362.41 g/mol
LogP4.90
Rot. Bonds4

About 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine

2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine (PubChem CID 53301189) has the molecular formula C21H19FN4O and a molecular weight of 362.41 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine
PubChem CID53301189
Molecular FormulaC21H19FN4O
Molecular Weight362.41 g/mol
Exact Mass362.15
IUPAC Name2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine
SMILESCOc1ccc(Nc2c(-c3ccc(F)cc3)nc3nc(C)cc(C)n23)cc1
InChIInChI=1S/C21H19FN4O/c1-13-12-14(2)26-20(24-17-8-10-18(27-3)11-9-17)19(25-21(26)23-13)15-4-6-16(22)7-5-15/h4-12,24H,1-3H3
InChIKeyCDLQJUZZIBSLEZ-UHFFFAOYSA-N
XLogP4.90
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-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

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine?
The IUPAC name of 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine (CID 53301189) is 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine?
The canonical SMILES for 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine is COc1ccc(Nc2c(-c3ccc(F)cc3)nc3nc(C)cc(C)n23)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine?
The InChIKey is CDLQJUZZIBSLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN4O/c1-13-12-14(2)26-20(24-17-8-10-18(27-3)11-9-17)19(25-21(26)23-13)15-4-6-16(22)7-5-15/h4-12,24H,1-3H3.
What are the key properties of 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine?
2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine has a molecular weight of 362.41 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(4-methoxyphenyl)-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine is sourced from PubChem (CID 53301189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).