5-amino-4-fluoro-2-methylphenol

C7H8FNO — CID 10154098

IUPAC5-amino-4-fluoro-2-methylphenol
SMILESCc1cc(F)c(N)cc1O
InChIInChI=1S/C7H8FNO/c1-4-2-5(8)6(9)3-7(4)10/h2-3,10H,9H2,1H3
InChIKeyHEAQOCBITATQEW-UHFFFAOYSA-N
MW141.14 g/mol
LogP1.42
Rot. Bonds

About 5-amino-4-fluoro-2-methylphenol

5-amino-4-fluoro-2-methylphenol (PubChem CID 10154098) has the molecular formula C7H8FNO and a molecular weight of 141.14 g/mol. Its IUPAC name is 5-amino-4-fluoro-2-methylphenol.

Molecular Properties

Compound Name5-amino-4-fluoro-2-methylphenol
PubChem CID10154098
Molecular FormulaC7H8FNO
Molecular Weight141.14 g/mol
Exact Mass141.06
IUPAC Name5-amino-4-fluoro-2-methylphenol
SMILESCc1cc(F)c(N)cc1O
InChIInChI=1S/C7H8FNO/c1-4-2-5(8)6(9)3-7(4)10/h2-3,10H,9H2,1H3
InChIKeyHEAQOCBITATQEW-UHFFFAOYSA-N
XLogP1.42
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.14
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-(2,5-difluoro-4-methylphenyl)-4-fluorophenol
CID 142543781
2-amino-5-methylbenzene-1,4-diol
CID 14549398
4-fluoro-2,5-dimethylphenol
CID 22627623
4-fluoro-6-methylbenzene-1,3-diamine;hydrate
CID 141142247
4-fluoro-6-methylbenzene-1,3-diamine;sulfuric acid;hydrate
CID 22610610
5-[(5-amino-4-fluoro-2-methylphenyl)disulfanyl]-2-fluoro-4-methylaniline
CID 90220032
5-amino-4-fluoro-2-(trifluoromethyl)phenol
CID 130766695
5-ethyl-4-fluoro-2-methylphenol
CID 118092212
ethane;4-fluoro-2-methyl-5-propan-2-ylphenol
CID 145193990
4-fluoro-5-(1-hydroxyethyl)-2-methylphenol
CID 117276801
5-amino-4-fluoro-N,2-dimethylbenzamide
CID 130507342
2-fluoro-5-methyl-4-methylsulfonylaniline
CID 141321054

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-fluoro-2-methylphenol?
The IUPAC name of 5-amino-4-fluoro-2-methylphenol (CID 10154098) is 5-amino-4-fluoro-2-methylphenol.
What is the SMILES notation for 5-amino-4-fluoro-2-methylphenol?
The canonical SMILES for 5-amino-4-fluoro-2-methylphenol is Cc1cc(F)c(N)cc1O.
What is the InChIKey of 5-amino-4-fluoro-2-methylphenol?
The InChIKey is HEAQOCBITATQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO/c1-4-2-5(8)6(9)3-7(4)10/h2-3,10H,9H2,1H3.
What are the key properties of 5-amino-4-fluoro-2-methylphenol?
5-amino-4-fluoro-2-methylphenol has a molecular weight of 141.14 g/mol, XLogP of 1.42, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-fluoro-2-methylphenol is sourced from PubChem (CID 10154098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).