4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine

C11H12F2N4O2 — CID 55080290

IUPAC4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine
SMILESCOc1ccc(-c2ncn(N)c2N)cc1OC(F)F
InChIInChI=1S/C11H12F2N4O2/c1-18-7-3-2-6(4-8(7)19-11(12)13)9-10(14)17(15)5-16-9/h2-5,11H,14-15H2,1H3
InChIKeyUKOTZXAKGDSIRB-UHFFFAOYSA-N
MW270.24 g/mol
LogP1.46
Rot. Bonds4

About 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine

4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine (PubChem CID 55080290) has the molecular formula C11H12F2N4O2 and a molecular weight of 270.24 g/mol. Its IUPAC name is 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine.

Molecular Properties

Compound Name4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine
PubChem CID55080290
Molecular FormulaC11H12F2N4O2
Molecular Weight270.24 g/mol
Exact Mass270.09
IUPAC Name4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine
SMILESCOc1ccc(-c2ncn(N)c2N)cc1OC(F)F
InChIInChI=1S/C11H12F2N4O2/c1-18-7-3-2-6(4-8(7)19-11(12)13)9-10(14)17(15)5-16-9/h2-5,11H,14-15H2,1H3
InChIKeyUKOTZXAKGDSIRB-UHFFFAOYSA-N
XLogP1.46
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.24
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine 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 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine?
The IUPAC name of 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine (CID 55080290) is 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine.
What is the SMILES notation for 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine?
The canonical SMILES for 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine is COc1ccc(-c2ncn(N)c2N)cc1OC(F)F.
What is the InChIKey of 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine?
The InChIKey is UKOTZXAKGDSIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F2N4O2/c1-18-7-3-2-6(4-8(7)19-11(12)13)9-10(14)17(15)5-16-9/h2-5,11H,14-15H2,1H3.
What are the key properties of 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine?
4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine has a molecular weight of 270.24 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(difluoromethoxy)-4-methoxyphenyl]imidazole-1,5-diamine is sourced from PubChem (CID 55080290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).