4-(naphthalen-2-ylamino)phenol

C16H13NO — CID 7141

IUPAC4-(naphthalen-2-ylamino)phenol
SMILESOc1ccc(Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H13NO/c18-16-9-7-14(8-10-16)17-15-6-5-12-3-1-2-4-13(12)11-15/h1-11,17-18H
InChIKeyRACMGQBQYYWANW-UHFFFAOYSA-N
MW235.29 g/mol
LogP4.29
Rot. Bonds2

About 4-(naphthalen-2-ylamino)phenol

4-(naphthalen-2-ylamino)phenol (PubChem CID 7141) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 4-(naphthalen-2-ylamino)phenol.

Molecular Properties

Compound Name4-(naphthalen-2-ylamino)phenol
PubChem CID7141
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name4-(naphthalen-2-ylamino)phenol
SMILESOc1ccc(Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H13NO/c18-16-9-7-14(8-10-16)17-15-6-5-12-3-1-2-4-13(12)11-15/h1-11,17-18H
InChIKeyRACMGQBQYYWANW-UHFFFAOYSA-N
XLogP4.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(naphthalen-2-ylamino)phenol?
The IUPAC name of 4-(naphthalen-2-ylamino)phenol (CID 7141) is 4-(naphthalen-2-ylamino)phenol.
What is the SMILES notation for 4-(naphthalen-2-ylamino)phenol?
The canonical SMILES for 4-(naphthalen-2-ylamino)phenol is Oc1ccc(Nc2ccc3ccccc3c2)cc1.
What is the InChIKey of 4-(naphthalen-2-ylamino)phenol?
The InChIKey is RACMGQBQYYWANW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c18-16-9-7-14(8-10-16)17-15-6-5-12-3-1-2-4-13(12)11-15/h1-11,17-18H.
What are the key properties of 4-(naphthalen-2-ylamino)phenol?
4-(naphthalen-2-ylamino)phenol has a molecular weight of 235.29 g/mol, XLogP of 4.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(naphthalen-2-ylamino)phenol is sourced from PubChem (CID 7141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).