N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine

C16H13F2N3 — CID 106558206

IUPACN-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine
SMILESCc1cn(-c2ccccc2)c(Nc2ccc(F)c(F)c2)n1
InChIInChI=1S/C16H13F2N3/c1-11-10-21(13-5-3-2-4-6-13)16(19-11)20-12-7-8-14(17)15(18)9-12/h2-10H,1H3,(H,19,20)
InChIKeyUBSBAFVDBSYOQJ-UHFFFAOYSA-N
MW285.30 g/mol
LogP4.20
Rot. Bonds3

About N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine

N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine (PubChem CID 106558206) has the molecular formula C16H13F2N3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine
PubChem CID106558206
Molecular FormulaC16H13F2N3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine
SMILESCc1cn(-c2ccccc2)c(Nc2ccc(F)c(F)c2)n1
InChIInChI=1S/C16H13F2N3/c1-11-10-21(13-5-3-2-4-6-13)16(19-11)20-12-7-8-14(17)15(18)9-12/h2-10H,1H3,(H,19,20)
InChIKeyUBSBAFVDBSYOQJ-UHFFFAOYSA-N
XLogP4.20
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-4-methyl-1-phenylimidazol-2-amine
CID 106558735
N-(3-bromo-4-methylphenyl)-4-methyl-1-phenylimidazol-2-amine
CID 106573028
N-(4-bromophenyl)-4-methyl-1-phenylimidazol-2-amine
CID 106558632
4-methyl-1-(3-methylphenyl)-N-phenylimidazol-2-amine
CID 106560180
1-(4-iodophenyl)-4-methyl-N-phenylimidazol-2-amine
CID 106554158
4-methyl-1-phenyl-N-(1-propan-2-ylpyrazol-4-yl)imidazol-2-amine
CID 106571085
2,6-dimethyl-N-(4-methyl-1-phenylimidazol-2-yl)pyridin-3-amine
CID 106576599
N-(3-chloro-2-methylphenyl)-4-methyl-1-phenylimidazol-2-amine
CID 106556333
1-(3-fluoro-2-methylphenyl)-4-methyl-N-phenylimidazol-2-amine
CID 106564030
1-cyclohexyl-N-(3,4-difluorophenyl)-4-methylimidazol-2-amine
CID 106558163
N-(2-chloro-4-iodophenyl)-4-methyl-1-phenylimidazol-2-amine
CID 107605161
1-(4-bromo-3-chlorophenyl)-4-methyl-N-phenylimidazol-2-amine
CID 107618232

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine?
The IUPAC name of N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine (CID 106558206) is N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine.
What is the SMILES notation for N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine?
The canonical SMILES for N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine is Cc1cn(-c2ccccc2)c(Nc2ccc(F)c(F)c2)n1.
What is the InChIKey of N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine?
The InChIKey is UBSBAFVDBSYOQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2N3/c1-11-10-21(13-5-3-2-4-6-13)16(19-11)20-12-7-8-14(17)15(18)9-12/h2-10H,1H3,(H,19,20).
What are the key properties of N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine?
N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine has a molecular weight of 285.30 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine is sourced from PubChem (CID 106558206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).