4-(4-hydroxyanilino)naphthalen-1-ol

C16H13NO2 — CID 3018220

IUPAC4-(4-hydroxyanilino)naphthalen-1-ol
SMILESOc1ccc(Nc2ccc(O)c3ccccc23)cc1
InChIInChI=1S/C16H13NO2/c18-12-7-5-11(6-8-12)17-15-9-10-16(19)14-4-2-1-3-13(14)15/h1-10,17-19H
InChIKeyJHZVBYOUVQPKER-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.99
Rot. Bonds2

About 4-(4-hydroxyanilino)naphthalen-1-ol

4-(4-hydroxyanilino)naphthalen-1-ol (PubChem CID 3018220) has the molecular formula C16H13NO2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 4-(4-hydroxyanilino)naphthalen-1-ol.

Molecular Properties

Compound Name4-(4-hydroxyanilino)naphthalen-1-ol
PubChem CID3018220
Molecular FormulaC16H13NO2
Molecular Weight251.29 g/mol
Exact Mass251.09
IUPAC Name4-(4-hydroxyanilino)naphthalen-1-ol
SMILESOc1ccc(Nc2ccc(O)c3ccccc23)cc1
InChIInChI=1S/C16H13NO2/c18-12-7-5-11(6-8-12)17-15-9-10-16(19)14-4-2-1-3-13(14)15/h1-10,17-19H
InChIKeyJHZVBYOUVQPKER-UHFFFAOYSA-N
XLogP3.99
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

8-Amino-2-naphthalenol
CID 8358
4-(2-Naphthylamino)phenol
CID 7141
1-Amino-4-naphthol
CID 17815
Vitamin K5
CID 6754
2,2,4-Trimethyl-1,2-dihydro-6-quinolinol
CID 599799
4-Amino-1-naphthol hydrochloride
CID 2723858
7-Amino-1-naphthol
CID 40116
1-Acetamido-7-naphthol
CID 80946
1-Naphthalenol, 5-amino-, hydrochloride (1:1)
CID 113052
5-Amino-1-naphthol
CID 65746
N-(5-Hydroxy-1-naphthalenyl)-N'-phenylurea
CID 4432275
Diarylurea deriv. 1a
CID 5330587

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxyanilino)naphthalen-1-ol?
The IUPAC name of 4-(4-hydroxyanilino)naphthalen-1-ol (CID 3018220) is 4-(4-hydroxyanilino)naphthalen-1-ol.
What is the SMILES notation for 4-(4-hydroxyanilino)naphthalen-1-ol?
The canonical SMILES for 4-(4-hydroxyanilino)naphthalen-1-ol is Oc1ccc(Nc2ccc(O)c3ccccc23)cc1.
What is the InChIKey of 4-(4-hydroxyanilino)naphthalen-1-ol?
The InChIKey is JHZVBYOUVQPKER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c18-12-7-5-11(6-8-12)17-15-9-10-16(19)14-4-2-1-3-13(14)15/h1-10,17-19H.
What are the key properties of 4-(4-hydroxyanilino)naphthalen-1-ol?
4-(4-hydroxyanilino)naphthalen-1-ol has a molecular weight of 251.29 g/mol, XLogP of 3.99, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxyanilino)naphthalen-1-ol is sourced from PubChem (CID 3018220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).