5-ethyl-4-methylnaphthalen-1-ol

C13H14O — CID 130033880

IUPAC5-ethyl-4-methylnaphthalen-1-ol
SMILESCCc1cccc2c(O)ccc(C)c12
InChIInChI=1S/C13H14O/c1-3-10-5-4-6-11-12(14)8-7-9(2)13(10)11/h4-8,14H,3H2,1-2H3
InChIKeyPNOQDNWCCJPGPR-UHFFFAOYSA-N
MW186.25 g/mol
LogP3.42
Rot. Bonds1

About 5-ethyl-4-methylnaphthalen-1-ol

5-ethyl-4-methylnaphthalen-1-ol (PubChem CID 130033880) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 5-ethyl-4-methylnaphthalen-1-ol.

Molecular Properties

Compound Name5-ethyl-4-methylnaphthalen-1-ol
PubChem CID130033880
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name5-ethyl-4-methylnaphthalen-1-ol
SMILESCCc1cccc2c(O)ccc(C)c12
InChIInChI=1S/C13H14O/c1-3-10-5-4-6-11-12(14)8-7-9(2)13(10)11/h4-8,14H,3H2,1-2H3
InChIKeyPNOQDNWCCJPGPR-UHFFFAOYSA-N
XLogP3.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethylbenzene-1,2-diol;3-methylbenzene-1,2-diol
CID 158712110
8-ethyl-5-methylnaphthalene-1-sulfonic acid
CID 168755774
4-(2,6-diethylphenyl)-2-methylphenol
CID 154385947
ethane;naphthalene-1,5-diol;propane
CID 161367010
(8-ethylnaphthalen-1-yl)methanol
CID 59514335
2-(2-ethylphenoxy)benzene-1,3-diol
CID 23109139
benzene;2-ethylphenol
CID 159726745
diethyl-(4-hydroxy-5-methylnaphthalen-1-yl)sulfanium
CID 158770111
bis(2,6-diethylphenol);1,4-xylene
CID 160641052
2-butoxy-3-ethylphenol
CID 67732111
1,2-dimethylnaphthalene;1-ethylnaphthalene
CID 158986916
3-ethyl-2-phenoxyphenol
CID 66865882

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methylnaphthalen-1-ol?
The IUPAC name of 5-ethyl-4-methylnaphthalen-1-ol (CID 130033880) is 5-ethyl-4-methylnaphthalen-1-ol.
What is the SMILES notation for 5-ethyl-4-methylnaphthalen-1-ol?
The canonical SMILES for 5-ethyl-4-methylnaphthalen-1-ol is CCc1cccc2c(O)ccc(C)c12.
What is the InChIKey of 5-ethyl-4-methylnaphthalen-1-ol?
The InChIKey is PNOQDNWCCJPGPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-3-10-5-4-6-11-12(14)8-7-9(2)13(10)11/h4-8,14H,3H2,1-2H3.
What are the key properties of 5-ethyl-4-methylnaphthalen-1-ol?
5-ethyl-4-methylnaphthalen-1-ol has a molecular weight of 186.25 g/mol, XLogP of 3.42, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methylnaphthalen-1-ol is sourced from PubChem (CID 130033880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).