1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine

C17H19N3O — CID 79502172

IUPAC1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1cccc(N2C(N)=NCC2c2ccc(C)cc2)c1
InChIInChI=1S/C17H19N3O/c1-12-6-8-13(9-7-12)16-11-19-17(18)20(16)14-4-3-5-15(10-14)21-2/h3-10,16H,11H2,1-2H3,(H2,18,19)
InChIKeyGJHWZIWVUGTTEW-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.88
Rot. Bonds3

About 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine

1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79502172) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79502172
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1cccc(N2C(N)=NCC2c2ccc(C)cc2)c1
InChIInChI=1S/C17H19N3O/c1-12-6-8-13(9-7-12)16-11-19-17(18)20(16)14-4-3-5-15(10-14)21-2/h3-10,16H,11H2,1-2H3,(H2,18,19)
InChIKeyGJHWZIWVUGTTEW-UHFFFAOYSA-N
XLogP2.88
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine (CID 79502172) is 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine is COc1cccc(N2C(N)=NCC2c2ccc(C)cc2)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is GJHWZIWVUGTTEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-12-6-8-13(9-7-12)16-11-19-17(18)20(16)14-4-3-5-15(10-14)21-2/h3-10,16H,11H2,1-2H3,(H2,18,19).
What are the key properties of 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine?
1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 281.36 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79502172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).