2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine

C23H23N5O — CID 71459167

IUPAC2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine
SMILESCOc1ccc(C2(c3cccc(-c4cncnc4)c3)N=C(N)C(C(C)C)=N2)cc1
InChIInChI=1S/C23H23N5O/c1-15(2)21-22(24)28-23(27-21,18-7-9-20(29-3)10-8-18)19-6-4-5-16(11-19)17-12-25-14-26-13-17/h4-15H,1-3H3,(H2,24,28)
InChIKeySFBOKXSMKXLXQE-UHFFFAOYSA-N
MW385.47 g/mol
LogP3.82
Rot. Bonds5

About 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine

2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine (PubChem CID 71459167) has the molecular formula C23H23N5O and a molecular weight of 385.47 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine
PubChem CID71459167
Molecular FormulaC23H23N5O
Molecular Weight385.47 g/mol
Exact Mass385.19
IUPAC Name2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine
SMILESCOc1ccc(C2(c3cccc(-c4cncnc4)c3)N=C(N)C(C(C)C)=N2)cc1
InChIInChI=1S/C23H23N5O/c1-15(2)21-22(24)28-23(27-21,18-7-9-20(29-3)10-8-18)19-6-4-5-16(11-19)17-12-25-14-26-13-17/h4-15H,1-3H3,(H2,24,28)
InChIKeySFBOKXSMKXLXQE-UHFFFAOYSA-N
XLogP3.82
TPSA85.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-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-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine?
The IUPAC name of 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine (CID 71459167) is 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine?
The canonical SMILES for 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine is COc1ccc(C2(c3cccc(-c4cncnc4)c3)N=C(N)C(C(C)C)=N2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine?
The InChIKey is SFBOKXSMKXLXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O/c1-15(2)21-22(24)28-23(27-21,18-7-9-20(29-3)10-8-18)19-6-4-5-16(11-19)17-12-25-14-26-13-17/h4-15H,1-3H3,(H2,24,28).
What are the key properties of 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine?
2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine has a molecular weight of 385.47 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-propan-2-yl-2-(3-pyrimidin-5-ylphenyl)imidazol-4-amine is sourced from PubChem (CID 71459167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).