7-amino-5-fluoronaphthalen-1-ol

C10H8FNO — CID 115014814

IUPAC7-amino-5-fluoronaphthalen-1-ol
SMILESNc1cc(F)c2cccc(O)c2c1
InChIInChI=1S/C10H8FNO/c11-9-5-6(12)4-8-7(9)2-1-3-10(8)13/h1-5,13H,12H2
InChIKeyBEIWCHMDKXISRX-UHFFFAOYSA-N
MW177.18 g/mol
LogP2.27
Rot. Bonds

About 7-amino-5-fluoronaphthalen-1-ol

7-amino-5-fluoronaphthalen-1-ol (PubChem CID 115014814) has the molecular formula C10H8FNO and a molecular weight of 177.18 g/mol. Its IUPAC name is 7-amino-5-fluoronaphthalen-1-ol.

Molecular Properties

Compound Name7-amino-5-fluoronaphthalen-1-ol
PubChem CID115014814
Molecular FormulaC10H8FNO
Molecular Weight177.18 g/mol
Exact Mass177.06
IUPAC Name7-amino-5-fluoronaphthalen-1-ol
SMILESNc1cc(F)c2cccc(O)c2c1
InChIInChI=1S/C10H8FNO/c11-9-5-6(12)4-8-7(9)2-1-3-10(8)13/h1-5,13H,12H2
InChIKeyBEIWCHMDKXISRX-UHFFFAOYSA-N
XLogP2.27
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 52.27
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 7-amino-5-fluoronaphthalen-1-ol?
The IUPAC name of 7-amino-5-fluoronaphthalen-1-ol (CID 115014814) is 7-amino-5-fluoronaphthalen-1-ol.
What is the SMILES notation for 7-amino-5-fluoronaphthalen-1-ol?
The canonical SMILES for 7-amino-5-fluoronaphthalen-1-ol is Nc1cc(F)c2cccc(O)c2c1.
What is the InChIKey of 7-amino-5-fluoronaphthalen-1-ol?
The InChIKey is BEIWCHMDKXISRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO/c11-9-5-6(12)4-8-7(9)2-1-3-10(8)13/h1-5,13H,12H2.
What are the key properties of 7-amino-5-fluoronaphthalen-1-ol?
7-amino-5-fluoronaphthalen-1-ol has a molecular weight of 177.18 g/mol, XLogP of 2.27, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-5-fluoronaphthalen-1-ol is sourced from PubChem (CID 115014814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).