7-amino-8-propan-2-ylnaphthalen-2-ol

C13H15NO — CID 115057677

IUPAC7-amino-8-propan-2-ylnaphthalen-2-ol
SMILESCC(C)c1c(N)ccc2ccc(O)cc12
InChIInChI=1S/C13H15NO/c1-8(2)13-11-7-10(15)5-3-9(11)4-6-12(13)14/h3-8,15H,14H2,1-2H3
InChIKeyWIYCDAKZNMZTDU-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.25
Rot. Bonds1

About 7-amino-8-propan-2-ylnaphthalen-2-ol

7-amino-8-propan-2-ylnaphthalen-2-ol (PubChem CID 115057677) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 7-amino-8-propan-2-ylnaphthalen-2-ol.

Molecular Properties

Compound Name7-amino-8-propan-2-ylnaphthalen-2-ol
PubChem CID115057677
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name7-amino-8-propan-2-ylnaphthalen-2-ol
SMILESCC(C)c1c(N)ccc2ccc(O)cc12
InChIInChI=1S/C13H15NO/c1-8(2)13-11-7-10(15)5-3-9(11)4-6-12(13)14/h3-8,15H,14H2,1-2H3
InChIKeyWIYCDAKZNMZTDU-UHFFFAOYSA-N
XLogP3.25
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.25
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-8-propan-2-ylnaphthalen-2-ol?
The IUPAC name of 7-amino-8-propan-2-ylnaphthalen-2-ol (CID 115057677) is 7-amino-8-propan-2-ylnaphthalen-2-ol.
What is the SMILES notation for 7-amino-8-propan-2-ylnaphthalen-2-ol?
The canonical SMILES for 7-amino-8-propan-2-ylnaphthalen-2-ol is CC(C)c1c(N)ccc2ccc(O)cc12.
What is the InChIKey of 7-amino-8-propan-2-ylnaphthalen-2-ol?
The InChIKey is WIYCDAKZNMZTDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-8(2)13-11-7-10(15)5-3-9(11)4-6-12(13)14/h3-8,15H,14H2,1-2H3.
What are the key properties of 7-amino-8-propan-2-ylnaphthalen-2-ol?
7-amino-8-propan-2-ylnaphthalen-2-ol has a molecular weight of 201.27 g/mol, XLogP of 3.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-8-propan-2-ylnaphthalen-2-ol is sourced from PubChem (CID 115057677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).