4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine

C13H16F2N4O2 — CID 62483599

IUPAC4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine
SMILESCCc1nc(-c2ccc(OC)c(OC(F)F)c2)c(N)n1N
InChIInChI=1S/C13H16F2N4O2/c1-3-10-18-11(12(16)19(10)17)7-4-5-8(20-2)9(6-7)21-13(14)15/h4-6,13H,3,16-17H2,1-2H3
InChIKeyOXWSALZOHZLIDP-UHFFFAOYSA-N
MW298.29 g/mol
LogP2.02
Rot. Bonds5

About 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine

4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine (PubChem CID 62483599) has the molecular formula C13H16F2N4O2 and a molecular weight of 298.29 g/mol. Its IUPAC name is 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine.

Molecular Properties

Compound Name4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine
PubChem CID62483599
Molecular FormulaC13H16F2N4O2
Molecular Weight298.29 g/mol
Exact Mass298.12
IUPAC Name4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine
SMILESCCc1nc(-c2ccc(OC)c(OC(F)F)c2)c(N)n1N
InChIInChI=1S/C13H16F2N4O2/c1-3-10-18-11(12(16)19(10)17)7-4-5-8(20-2)9(6-7)21-13(14)15/h4-6,13H,3,16-17H2,1-2H3
InChIKeyOXWSALZOHZLIDP-UHFFFAOYSA-N
XLogP2.02
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.29
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-methylimidazole-1,5-diamine
CID 62482978
4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine
CID 62506121
2-ethyl-5-(3-fluoro-4-methoxyphenyl)-3-methylimidazol-4-amine
CID 65096550
5-(3,4-dimethoxyphenyl)-3-methyl-2-propylimidazol-4-amine
CID 62220657
2-ethyl-4-(4-phenylphenyl)imidazole-1,5-diamine
CID 62483793
2-ethyl-4-[4-(trifluoromethyl)phenyl]imidazole-1,5-diamine
CID 62483401
2-cyclopropyl-4-(3,4-dimethoxyphenyl)imidazole-1,5-diamine
CID 62483620
4-(3-chlorophenyl)-2-ethylimidazole-1,5-diamine
CID 62483208
2-ethyl-4-(3-propoxyphenyl)imidazole-1,5-diamine
CID 55079214
5-(5-amino-2-ethyl-1-methylimidazol-4-yl)-2-methoxybenzonitrile
CID 65336015
5-(3-bromo-4-methoxyphenyl)-3-butyl-2-ethylimidazol-4-amine
CID 62219915
2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine
CID 65096454

Frequently Asked Questions

What is the IUPAC name of 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine?
The IUPAC name of 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine (CID 62483599) is 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine.
What is the SMILES notation for 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine?
The canonical SMILES for 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine is CCc1nc(-c2ccc(OC)c(OC(F)F)c2)c(N)n1N.
What is the InChIKey of 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine?
The InChIKey is OXWSALZOHZLIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N4O2/c1-3-10-18-11(12(16)19(10)17)7-4-5-8(20-2)9(6-7)21-13(14)15/h4-6,13H,3,16-17H2,1-2H3.
What are the key properties of 4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine?
4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine has a molecular weight of 298.29 g/mol, XLogP of 2.02, 5 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]-2-ethylimidazole-1,5-diamine is sourced from PubChem (CID 62483599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).