5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine

C19H20F3N3O — CID 141215323

IUPAC5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine
SMILESCN1CC(c2ccccc2)(c2ccc(OC(F)F)c(CCF)c2)N=C1N
InChIInChI=1S/C19H20F3N3O/c1-25-12-19(24-18(25)23,14-5-3-2-4-6-14)15-7-8-16(26-17(21)22)13(11-15)9-10-20/h2-8,11,17H,9-10,12H2,1H3,(H2,23,24)
InChIKeyGOXYMWJZCJBPIC-UHFFFAOYSA-N
MW363.38 g/mol
LogP3.30
Rot. Bonds6

About 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine

5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine (PubChem CID 141215323) has the molecular formula C19H20F3N3O and a molecular weight of 363.38 g/mol. Its IUPAC name is 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine
PubChem CID141215323
Molecular FormulaC19H20F3N3O
Molecular Weight363.38 g/mol
Exact Mass363.16
IUPAC Name5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine
SMILESCN1CC(c2ccccc2)(c2ccc(OC(F)F)c(CCF)c2)N=C1N
InChIInChI=1S/C19H20F3N3O/c1-25-12-19(24-18(25)23,14-5-3-2-4-6-14)15-7-8-16(26-17(21)22)13(11-15)9-10-20/h2-8,11,17H,9-10,12H2,1H3,(H2,23,24)
InChIKeyGOXYMWJZCJBPIC-UHFFFAOYSA-N
XLogP3.30
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenylimidazol-4-one
CID 25073051
5-(3-anilinophenyl)-5-[4-(difluoromethoxy)phenyl]-3-methyl-4H-imidazol-2-amine
CID 141217605
5-[4-(difluoromethoxy)phenyl]-5-[3-(6-fluorohexyl)phenyl]-3-methyl-4H-imidazol-2-amine
CID 141167360
5-[4-(difluoromethoxy)phenyl]-5-[3-(4-fluorobutyl)phenyl]-3-methyl-4H-imidazol-2-amine
CID 141167351
(5S)-5-[3-(2,2-difluoroethoxy)-4-fluorophenyl]-5-[4-(difluoromethoxy)phenyl]-3-methyl-4H-imidazol-2-amine
CID 151231761
5-[4-(difluoromethoxy)phenyl]-5-(3-hex-5-enylphenyl)-3-methyl-4H-imidazol-2-amine
CID 68735881
2-amino-5-[4-(difluoromethoxy)-3-propylphenyl]-3-methyl-5-phenylimidazol-4-one
CID 25071168
5-[3-(3-ethoxyphenyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine
CID 141178336
1-[3-[3-(2-amino-3-methyl-5-phenyl-4H-imidazol-5-yl)phenyl]phenyl]ethanone
CID 141178360
2-amino-5-[4-(difluoromethoxy)-3-ethylphenyl]-5-[4-fluoro-3-(fluoromethyl)phenyl]-3-methylimidazol-4-one
CID 71032909
5-(3-chloro-4-methoxyphenyl)-3-methyl-5-(3-pyridin-3-ylphenyl)-4H-imidazol-2-amine
CID 141128116
(5R)-2-amino-5-[4-(difluoromethoxy)-3-ethenylphenyl]-3-methyl-5-phenylimidazol-4-one
CID 69002381

Frequently Asked Questions

What is the IUPAC name of 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine?
The IUPAC name of 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine (CID 141215323) is 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine.
What is the SMILES notation for 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine?
The canonical SMILES for 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine is CN1CC(c2ccccc2)(c2ccc(OC(F)F)c(CCF)c2)N=C1N.
What is the InChIKey of 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine?
The InChIKey is GOXYMWJZCJBPIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3N3O/c1-25-12-19(24-18(25)23,14-5-3-2-4-6-14)15-7-8-16(26-17(21)22)13(11-15)9-10-20/h2-8,11,17H,9-10,12H2,1H3,(H2,23,24).
What are the key properties of 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine?
5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine has a molecular weight of 363.38 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(difluoromethoxy)-3-(2-fluoroethyl)phenyl]-3-methyl-5-phenyl-4H-imidazol-2-amine is sourced from PubChem (CID 141215323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).