4-amino-5,6-difluoronaphthalen-2-ol

C10H7F2NO — CID 164921931

IUPAC4-amino-5,6-difluoronaphthalen-2-ol
SMILESNc1cc(O)cc2ccc(F)c(F)c12
InChIInChI=1S/C10H7F2NO/c11-7-2-1-5-3-6(14)4-8(13)9(5)10(7)12/h1-4,14H,13H2
InChIKeyJODAQRALDYGWGB-UHFFFAOYSA-N
MW195.17 g/mol
LogP2.41
Rot. Bonds

About 4-amino-5,6-difluoronaphthalen-2-ol

4-amino-5,6-difluoronaphthalen-2-ol (PubChem CID 164921931) has the molecular formula C10H7F2NO and a molecular weight of 195.17 g/mol. Its IUPAC name is 4-amino-5,6-difluoronaphthalen-2-ol.

Molecular Properties

Compound Name4-amino-5,6-difluoronaphthalen-2-ol
PubChem CID164921931
Molecular FormulaC10H7F2NO
Molecular Weight195.17 g/mol
Exact Mass195.05
IUPAC Name4-amino-5,6-difluoronaphthalen-2-ol
SMILESNc1cc(O)cc2ccc(F)c(F)c12
InChIInChI=1S/C10H7F2NO/c11-7-2-1-5-3-6(14)4-8(13)9(5)10(7)12/h1-4,14H,13H2
InChIKeyJODAQRALDYGWGB-UHFFFAOYSA-N
XLogP2.41
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.17
LogP ≤ 52.41
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

4-amino-5-bromo-6-fluoronaphthalen-2-ol
CID 176974538
4-amino-5,6-dichloronaphthalen-2-ol
CID 171656642
2-(4-amino-5,6-difluoronaphthalen-2-yl)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 89076614
3-amino-5-fluoro-4-methylphenol
CID 131277286
1,2,8-trifluoro-6-(2,3,4,5,6-pentafluorophenyl)naphthalene
CID 123149014
8-bromo-1,2-difluoro-6-methylnaphthalene
CID 174273019
4-tert-butyl-5-ethyl-6-fluoronaphthalen-2-ol
CID 169009475
3-amino-4-fluorophenol;oxolane
CID 175270087
3,4,5-trifluorophenol
CID 2777943
3,4-difluorobenzene-1,2-diamine
CID 2736753
4-tert-butyl-5-cyclopropyl-6-fluoronaphthalen-2-ol
CID 170107153
6-fluoro-4-propan-2-yl-5-prop-1-ynylnaphthalen-2-ol
CID 170081699

Frequently Asked Questions

What is the IUPAC name of 4-amino-5,6-difluoronaphthalen-2-ol?
The IUPAC name of 4-amino-5,6-difluoronaphthalen-2-ol (CID 164921931) is 4-amino-5,6-difluoronaphthalen-2-ol.
What is the SMILES notation for 4-amino-5,6-difluoronaphthalen-2-ol?
The canonical SMILES for 4-amino-5,6-difluoronaphthalen-2-ol is Nc1cc(O)cc2ccc(F)c(F)c12.
What is the InChIKey of 4-amino-5,6-difluoronaphthalen-2-ol?
The InChIKey is JODAQRALDYGWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2NO/c11-7-2-1-5-3-6(14)4-8(13)9(5)10(7)12/h1-4,14H,13H2.
What are the key properties of 4-amino-5,6-difluoronaphthalen-2-ol?
4-amino-5,6-difluoronaphthalen-2-ol has a molecular weight of 195.17 g/mol, XLogP of 2.41, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5,6-difluoronaphthalen-2-ol is sourced from PubChem (CID 164921931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).