1-(3-phenoxyphenyl)imidazol-2-amine

C15H13N3O — CID 106566517

IUPAC1-(3-phenoxyphenyl)imidazol-2-amine
SMILESNc1nccn1-c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C15H13N3O/c16-15-17-9-10-18(15)12-5-4-8-14(11-12)19-13-6-2-1-3-7-13/h1-11H,(H2,16,17)
InChIKeyRRKHBZSNKKIAIM-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.25
Rot. Bonds3

About 1-(3-phenoxyphenyl)imidazol-2-amine

1-(3-phenoxyphenyl)imidazol-2-amine (PubChem CID 106566517) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 1-(3-phenoxyphenyl)imidazol-2-amine.

Molecular Properties

Compound Name1-(3-phenoxyphenyl)imidazol-2-amine
PubChem CID106566517
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name1-(3-phenoxyphenyl)imidazol-2-amine
SMILESNc1nccn1-c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C15H13N3O/c16-15-17-9-10-18(15)12-5-4-8-14(11-12)19-13-6-2-1-3-7-13/h1-11H,(H2,16,17)
InChIKeyRRKHBZSNKKIAIM-UHFFFAOYSA-N
XLogP3.25
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-phenoxyphenyl)imidazol-2-amine?
The IUPAC name of 1-(3-phenoxyphenyl)imidazol-2-amine (CID 106566517) is 1-(3-phenoxyphenyl)imidazol-2-amine.
What is the SMILES notation for 1-(3-phenoxyphenyl)imidazol-2-amine?
The canonical SMILES for 1-(3-phenoxyphenyl)imidazol-2-amine is Nc1nccn1-c1cccc(Oc2ccccc2)c1.
What is the InChIKey of 1-(3-phenoxyphenyl)imidazol-2-amine?
The InChIKey is RRKHBZSNKKIAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c16-15-17-9-10-18(15)12-5-4-8-14(11-12)19-13-6-2-1-3-7-13/h1-11H,(H2,16,17).
What are the key properties of 1-(3-phenoxyphenyl)imidazol-2-amine?
1-(3-phenoxyphenyl)imidazol-2-amine has a molecular weight of 251.29 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-phenoxyphenyl)imidazol-2-amine is sourced from PubChem (CID 106566517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).