2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol

C12H17NO — CID 28573020

IUPAC2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol
SMILESOCCNc1cccc2c1CCCC2
InChIInChI=1S/C12H17NO/c14-9-8-13-12-7-3-5-10-4-1-2-6-11(10)12/h3,5,7,13-14H,1-2,4,6,8-9H2
InChIKeyPQPJGYHOOIKZHW-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.97
Rot. Bonds3

About 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol

2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol (PubChem CID 28573020) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol.

Molecular Properties

Compound Name2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol
PubChem CID28573020
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol
SMILESOCCNc1cccc2c1CCCC2
InChIInChI=1S/C12H17NO/c14-9-8-13-12-7-3-5-10-4-1-2-6-11(10)12/h3,5,7,13-14H,1-2,4,6,8-9H2
InChIKeyPQPJGYHOOIKZHW-UHFFFAOYSA-N
XLogP1.97
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol 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 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol?
The IUPAC name of 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol (CID 28573020) is 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol.
What is the SMILES notation for 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol?
The canonical SMILES for 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol is OCCNc1cccc2c1CCCC2.
What is the InChIKey of 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol?
The InChIKey is PQPJGYHOOIKZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c14-9-8-13-12-7-3-5-10-4-1-2-6-11(10)12/h3,5,7,13-14H,1-2,4,6,8-9H2.
What are the key properties of 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol?
2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol has a molecular weight of 191.27 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethanol is sourced from PubChem (CID 28573020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).