1-(3,4-difluorophenyl)-4-methylimidazol-2-amine

C10H9F2N3 — CID 106558202

IUPAC1-(3,4-difluorophenyl)-4-methylimidazol-2-amine
SMILESCc1cn(-c2ccc(F)c(F)c2)c(N)n1
InChIInChI=1S/C10H9F2N3/c1-6-5-15(10(13)14-6)7-2-3-8(11)9(12)4-7/h2-5H,1H3,(H2,13,14)
InChIKeyNTNGMQBPWAONJY-UHFFFAOYSA-N
MW209.20 g/mol
LogP2.04
Rot. Bonds1

About 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine

1-(3,4-difluorophenyl)-4-methylimidazol-2-amine (PubChem CID 106558202) has the molecular formula C10H9F2N3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-(3,4-difluorophenyl)-4-methylimidazol-2-amine
PubChem CID106558202
Molecular FormulaC10H9F2N3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name1-(3,4-difluorophenyl)-4-methylimidazol-2-amine
SMILESCc1cn(-c2ccc(F)c(F)c2)c(N)n1
InChIInChI=1S/C10H9F2N3/c1-6-5-15(10(13)14-6)7-2-3-8(11)9(12)4-7/h2-5H,1H3,(H2,13,14)
InChIKeyNTNGMQBPWAONJY-UHFFFAOYSA-N
XLogP2.04
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-bromo-3-methylphenyl)-4-methylimidazol-2-amine
CID 106557045
4-methyl-1-(4-methylsulfanylphenyl)imidazol-2-amine
CID 106556635
1-(3,5-dichlorophenyl)-4-methylimidazol-2-amine
CID 106557272
1-(2-fluoro-4-methylphenyl)-4-methylimidazol-2-amine
CID 106560440
1-(2-fluoro-5-methoxyphenyl)-4-methylimidazol-2-amine
CID 106577006
4-methyl-1-(2,3,5-trifluorophenyl)imidazol-2-amine
CID 106570978
1-(3-bromo-5-methoxyphenyl)-4-methylimidazol-2-amine
CID 106579362
1-(4-chloro-3-fluorophenyl)-N,4-dimethylimidazol-2-amine
CID 106567668
1-(4-fluoro-3-methylphenyl)imidazol-2-amine
CID 106570575
1-(2,5-dichloro-4-methylphenyl)-4-methylimidazol-2-amine
CID 106580639
N-(3,4-difluorophenyl)-4-methyl-1-phenylimidazol-2-amine
CID 106558206
3-(2,4-dimethylimidazol-1-yl)aniline
CID 82512201

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine?
The IUPAC name of 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine (CID 106558202) is 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine.
What is the SMILES notation for 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine?
The canonical SMILES for 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine is Cc1cn(-c2ccc(F)c(F)c2)c(N)n1.
What is the InChIKey of 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine?
The InChIKey is NTNGMQBPWAONJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3/c1-6-5-15(10(13)14-6)7-2-3-8(11)9(12)4-7/h2-5H,1H3,(H2,13,14).
What are the key properties of 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine?
1-(3,4-difluorophenyl)-4-methylimidazol-2-amine has a molecular weight of 209.20 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-difluorophenyl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106558202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).