5-amino-7,8-difluoronaphthalen-2-ol

C10H7F2NO — CID 141091751

IUPAC5-amino-7,8-difluoronaphthalen-2-ol
SMILESNc1cc(F)c(F)c2cc(O)ccc12
InChIInChI=1S/C10H7F2NO/c11-8-4-9(13)6-2-1-5(14)3-7(6)10(8)12/h1-4,14H,13H2
InChIKeyTVAPFYIFEZWLSE-UHFFFAOYSA-N
MW195.17 g/mol
LogP2.41
Rot. Bonds

About 5-amino-7,8-difluoronaphthalen-2-ol

5-amino-7,8-difluoronaphthalen-2-ol (PubChem CID 141091751) has the molecular formula C10H7F2NO and a molecular weight of 195.17 g/mol. Its IUPAC name is 5-amino-7,8-difluoronaphthalen-2-ol.

Molecular Properties

Compound Name5-amino-7,8-difluoronaphthalen-2-ol
PubChem CID141091751
Molecular FormulaC10H7F2NO
Molecular Weight195.17 g/mol
Exact Mass195.05
IUPAC Name5-amino-7,8-difluoronaphthalen-2-ol
SMILESNc1cc(F)c(F)c2cc(O)ccc12
InChIInChI=1S/C10H7F2NO/c11-8-4-9(13)6-2-1-5(14)3-7(6)10(8)12/h1-4,14H,13H2
InChIKeyTVAPFYIFEZWLSE-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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Frequently Asked Questions

What is the IUPAC name of 5-amino-7,8-difluoronaphthalen-2-ol?
The IUPAC name of 5-amino-7,8-difluoronaphthalen-2-ol (CID 141091751) is 5-amino-7,8-difluoronaphthalen-2-ol.
What is the SMILES notation for 5-amino-7,8-difluoronaphthalen-2-ol?
The canonical SMILES for 5-amino-7,8-difluoronaphthalen-2-ol is Nc1cc(F)c(F)c2cc(O)ccc12.
What is the InChIKey of 5-amino-7,8-difluoronaphthalen-2-ol?
The InChIKey is TVAPFYIFEZWLSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2NO/c11-8-4-9(13)6-2-1-5(14)3-7(6)10(8)12/h1-4,14H,13H2.
What are the key properties of 5-amino-7,8-difluoronaphthalen-2-ol?
5-amino-7,8-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 5-amino-7,8-difluoronaphthalen-2-ol is sourced from PubChem (CID 141091751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).