1-N,4-diphenylimidazole-1,2-diamine

C15H14N4 — CID 739077

IUPAC1-N,4-diphenylimidazole-1,2-diamine
SMILESNc1nc(-c2ccccc2)cn1Nc1ccccc1
InChIInChI=1S/C15H14N4/c16-15-17-14(12-7-3-1-4-8-12)11-19(15)18-13-9-5-2-6-10-13/h1-11,18H,(H2,16,17)
InChIKeyYBKJMOUSYMEVNR-UHFFFAOYSA-N
MW250.31 g/mol
LogP3.01
Rot. Bonds3

About 1-N,4-diphenylimidazole-1,2-diamine

1-N,4-diphenylimidazole-1,2-diamine (PubChem CID 739077) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 1-N,4-diphenylimidazole-1,2-diamine.

Molecular Properties

Compound Name1-N,4-diphenylimidazole-1,2-diamine
PubChem CID739077
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name1-N,4-diphenylimidazole-1,2-diamine
SMILESNc1nc(-c2ccccc2)cn1Nc1ccccc1
InChIInChI=1S/C15H14N4/c16-15-17-14(12-7-3-1-4-8-12)11-19(15)18-13-9-5-2-6-10-13/h1-11,18H,(H2,16,17)
InChIKeyYBKJMOUSYMEVNR-UHFFFAOYSA-N
XLogP3.01
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-N,4-diphenylimidazole-1,2-diamine?
The IUPAC name of 1-N,4-diphenylimidazole-1,2-diamine (CID 739077) is 1-N,4-diphenylimidazole-1,2-diamine.
What is the SMILES notation for 1-N,4-diphenylimidazole-1,2-diamine?
The canonical SMILES for 1-N,4-diphenylimidazole-1,2-diamine is Nc1nc(-c2ccccc2)cn1Nc1ccccc1.
What is the InChIKey of 1-N,4-diphenylimidazole-1,2-diamine?
The InChIKey is YBKJMOUSYMEVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c16-15-17-14(12-7-3-1-4-8-12)11-19(15)18-13-9-5-2-6-10-13/h1-11,18H,(H2,16,17).
What are the key properties of 1-N,4-diphenylimidazole-1,2-diamine?
1-N,4-diphenylimidazole-1,2-diamine has a molecular weight of 250.31 g/mol, XLogP of 3.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-diphenylimidazole-1,2-diamine is sourced from PubChem (CID 739077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).