2-ethylnaphthalen-1-ol

C12H12O — CID 11095090

IUPAC2-ethylnaphthalen-1-ol
SMILESCCc1ccc2ccccc2c1O
InChIInChI=1S/C12H12O/c1-2-9-7-8-10-5-3-4-6-11(10)12(9)13/h3-8,13H,2H2,1H3
InChIKeyKSTGSVANFMJGGB-UHFFFAOYSA-N
MW172.23 g/mol
LogP3.11
Rot. Bonds1

About 2-ethylnaphthalen-1-ol

2-ethylnaphthalen-1-ol (PubChem CID 11095090) has the molecular formula C12H12O and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-ethylnaphthalen-1-ol.

Molecular Properties

Compound Name2-ethylnaphthalen-1-ol
PubChem CID11095090
Molecular FormulaC12H12O
Molecular Weight172.23 g/mol
Exact Mass172.09
IUPAC Name2-ethylnaphthalen-1-ol
SMILESCCc1ccc2ccccc2c1O
InChIInChI=1S/C12H12O/c1-2-9-7-8-10-5-3-4-6-11(10)12(9)13/h3-8,13H,2H2,1H3
InChIKeyKSTGSVANFMJGGB-UHFFFAOYSA-N
XLogP3.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-ethylnaphthalen-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

CID 6989
CID 6989
CID 8663
CID 8663
CID 7005
CID 7005
CID 7017
CID 7017
CID 10364
CID 10364
CID 7267
CID 7267
CID 10687
CID 10687
CID 10229
CID 10229
CID 21387
CID 21387
CID 11305
CID 11305
CID 6815
CID 6815
CID 6937
CID 6937

Frequently Asked Questions

What is the IUPAC name of 2-ethylnaphthalen-1-ol?
The IUPAC name of 2-ethylnaphthalen-1-ol (CID 11095090) is 2-ethylnaphthalen-1-ol.
What is the SMILES notation for 2-ethylnaphthalen-1-ol?
The canonical SMILES for 2-ethylnaphthalen-1-ol is CCc1ccc2ccccc2c1O.
What is the InChIKey of 2-ethylnaphthalen-1-ol?
The InChIKey is KSTGSVANFMJGGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O/c1-2-9-7-8-10-5-3-4-6-11(10)12(9)13/h3-8,13H,2H2,1H3.
What are the key properties of 2-ethylnaphthalen-1-ol?
2-ethylnaphthalen-1-ol has a molecular weight of 172.23 g/mol, XLogP of 3.11, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylnaphthalen-1-ol is sourced from PubChem (CID 11095090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).