5-fluoro-4-phenyl-1H-imidazol-2-amine

C9H8FN3 — CID 141443454

IUPAC5-fluoro-4-phenyl-1H-imidazol-2-amine
SMILESNc1nc(-c2ccccc2)c(F)[nH]1
InChIInChI=1S/C9H8FN3/c10-8-7(12-9(11)13-8)6-4-2-1-3-5-6/h1-5H,(H3,11,12,13)
InChIKeyKHMBJVFWYRTAEA-UHFFFAOYSA-N
MW177.18 g/mol
LogP1.80
Rot. Bonds1

About 5-fluoro-4-phenyl-1H-imidazol-2-amine

5-fluoro-4-phenyl-1H-imidazol-2-amine (PubChem CID 141443454) has the molecular formula C9H8FN3 and a molecular weight of 177.18 g/mol. Its IUPAC name is 5-fluoro-4-phenyl-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-fluoro-4-phenyl-1H-imidazol-2-amine
PubChem CID141443454
Molecular FormulaC9H8FN3
Molecular Weight177.18 g/mol
Exact Mass177.07
IUPAC Name5-fluoro-4-phenyl-1H-imidazol-2-amine
SMILESNc1nc(-c2ccccc2)c(F)[nH]1
InChIInChI=1S/C9H8FN3/c10-8-7(12-9(11)13-8)6-4-2-1-3-5-6/h1-5H,(H3,11,12,13)
InChIKeyKHMBJVFWYRTAEA-UHFFFAOYSA-N
XLogP1.80
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-4-(4-fluorophenyl)-1H-imidazole-5-carboxylic acid
CID 82472728
7-phenyl-1H-pyrazolo[4,5-d]pyrimidin-5-amine
CID 76847208
4-(4-fluorophenyl)-2-phenyl-1,3-thiazol-5-amine
CID 25008167
2,3,5-triphenyl-6-[4-(3,5,6-triphenylpyrazin-2-yl)phenyl]pyrazine
CID 139681938
2-amino-4-(3,4-difluorophenyl)-1H-imidazole-5-carboxylic acid
CID 82477054
2-chloro-5-fluoro-6-phenylpyrimidin-4-amine
CID 129216031
2,4-diamino-5-phenyl-1H-pyrimidin-6-one
CID 135448367
5-benzyl-4-(4-fluorophenyl)-6-phenylpyrimidin-2-amine
CID 139449767
2,4-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-6-amine
CID 175490539
7-amino-3,4-diphenyl-6H-pyrimido[4,5-c]pyridazin-5-one
CID 135837392
5-(4-hexylphenyl)-4-phenyl-1H-imidazol-2-amine
CID 70689163
4-nitroso-5-phenyl-1H-imidazol-2-amine
CID 13012268

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-phenyl-1H-imidazol-2-amine?
The IUPAC name of 5-fluoro-4-phenyl-1H-imidazol-2-amine (CID 141443454) is 5-fluoro-4-phenyl-1H-imidazol-2-amine.
What is the SMILES notation for 5-fluoro-4-phenyl-1H-imidazol-2-amine?
The canonical SMILES for 5-fluoro-4-phenyl-1H-imidazol-2-amine is Nc1nc(-c2ccccc2)c(F)[nH]1.
What is the InChIKey of 5-fluoro-4-phenyl-1H-imidazol-2-amine?
The InChIKey is KHMBJVFWYRTAEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3/c10-8-7(12-9(11)13-8)6-4-2-1-3-5-6/h1-5H,(H3,11,12,13).
What are the key properties of 5-fluoro-4-phenyl-1H-imidazol-2-amine?
5-fluoro-4-phenyl-1H-imidazol-2-amine has a molecular weight of 177.18 g/mol, XLogP of 1.80, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-phenyl-1H-imidazol-2-amine is sourced from PubChem (CID 141443454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).