3-amino-4a,8a-dihydronaphthalen-2-ol

C10H11NO — CID 59918684

IUPAC3-amino-4a,8a-dihydronaphthalen-2-ol
SMILESNC1=CC2C=CC=CC2C=C1O
InChIInChI=1S/C10H11NO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-8,12H,11H2
InChIKeyNJGSOVXNHMYFLP-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.64
Rot. Bonds

About 3-amino-4a,8a-dihydronaphthalen-2-ol

3-amino-4a,8a-dihydronaphthalen-2-ol (PubChem CID 59918684) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 3-amino-4a,8a-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name3-amino-4a,8a-dihydronaphthalen-2-ol
PubChem CID59918684
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name3-amino-4a,8a-dihydronaphthalen-2-ol
SMILESNC1=CC2C=CC=CC2C=C1O
InChIInChI=1S/C10H11NO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-8,12H,11H2
InChIKeyNJGSOVXNHMYFLP-UHFFFAOYSA-N
XLogP1.64
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-4a,8a-dihydronaphthalen-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-amino-4a,8a-dihydronaphthalen-2-ol?
The IUPAC name of 3-amino-4a,8a-dihydronaphthalen-2-ol (CID 59918684) is 3-amino-4a,8a-dihydronaphthalen-2-ol.
What is the SMILES notation for 3-amino-4a,8a-dihydronaphthalen-2-ol?
The canonical SMILES for 3-amino-4a,8a-dihydronaphthalen-2-ol is NC1=CC2C=CC=CC2C=C1O.
What is the InChIKey of 3-amino-4a,8a-dihydronaphthalen-2-ol?
The InChIKey is NJGSOVXNHMYFLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-8,12H,11H2.
What are the key properties of 3-amino-4a,8a-dihydronaphthalen-2-ol?
3-amino-4a,8a-dihydronaphthalen-2-ol has a molecular weight of 161.20 g/mol, XLogP of 1.64, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4a,8a-dihydronaphthalen-2-ol is sourced from PubChem (CID 59918684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).