1-aminonaphthalen-2-ol

C10H9NO — CID 14535

IUPAC1-aminonaphthalen-2-ol
SMILESNc1c(O)ccc2ccccc12
InChIInChI=1S/C10H9NO/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-6,12H,11H2
InChIKeyFHMMQQXRSYSWCM-UHFFFAOYSA-N
MW159.19 g/mol
LogP2.13
Rot. Bonds

About 1-aminonaphthalen-2-ol

1-aminonaphthalen-2-ol (PubChem CID 14535) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 1-aminonaphthalen-2-ol.

Molecular Properties

Compound Name1-aminonaphthalen-2-ol
PubChem CID14535
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name1-aminonaphthalen-2-ol
SMILESNc1c(O)ccc2ccccc12
InChIInChI=1S/C10H9NO/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-6,12H,11H2
InChIKeyFHMMQQXRSYSWCM-UHFFFAOYSA-N
XLogP2.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-aminonaphthalen-2-ol?
The IUPAC name of 1-aminonaphthalen-2-ol (CID 14535) is 1-aminonaphthalen-2-ol.
What is the SMILES notation for 1-aminonaphthalen-2-ol?
The canonical SMILES for 1-aminonaphthalen-2-ol is Nc1c(O)ccc2ccccc12.
What is the InChIKey of 1-aminonaphthalen-2-ol?
The InChIKey is FHMMQQXRSYSWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c11-10-8-4-2-1-3-7(8)5-6-9(10)12/h1-6,12H,11H2.
What are the key properties of 1-aminonaphthalen-2-ol?
1-aminonaphthalen-2-ol has a molecular weight of 159.19 g/mol, XLogP of 2.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminonaphthalen-2-ol is sourced from PubChem (CID 14535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).