ethane;1-methoxy-4-methylnaphthalen-2-ol

C14H18O2 — CID 142864573

IUPACethane;1-methoxy-4-methylnaphthalen-2-ol
SMILESCC.COc1c(O)cc(C)c2ccccc12
InChIInChI=1S/C12H12O2.C2H6/c1-8-7-11(13)12(14-2)10-6-4-3-5-9(8)10;1-2/h3-7,13H,1-2H3;1-2H3
InChIKeyWGGOZAQFJTWQKD-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.89
Rot. Bonds1

About ethane;1-methoxy-4-methylnaphthalen-2-ol

ethane;1-methoxy-4-methylnaphthalen-2-ol (PubChem CID 142864573) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is ethane;1-methoxy-4-methylnaphthalen-2-ol.

Molecular Properties

Compound Nameethane;1-methoxy-4-methylnaphthalen-2-ol
PubChem CID142864573
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Nameethane;1-methoxy-4-methylnaphthalen-2-ol
SMILESCC.COc1c(O)cc(C)c2ccccc12
InChIInChI=1S/C12H12O2.C2H6/c1-8-7-11(13)12(14-2)10-6-4-3-5-9(8)10;1-2/h3-7,13H,1-2H3;1-2H3
InChIKeyWGGOZAQFJTWQKD-UHFFFAOYSA-N
XLogP3.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-3-methyl-5-phenylphenol
CID 132557865
3,4-dimethylnaphthalen-1-ol
CID 15915434
3-methoxy-9-methylphenanthren-2-ol
CID 10514087
disodium;(4-hydroxy-2-methylnaphthalen-1-yl) phosphate
CID 70120911
3-methyl-4-phenylmethoxynaphthalen-1-ol
CID 12051652
2-(4-hydroxy-2-methylnaphthalen-1-yl)oxyacetonitrile
CID 53376360
4-methoxy-3,5-dimethylphenol
CID 643378
3-methyl-4-propan-2-ylnaphthalen-1-ol
CID 163727490
2-[(2-methoxy-3,5-dimethylphenyl)diazenyl]phenol
CID 135597406
5,7-dimethylnaphthalen-1-ol
CID 599056
2-methoxy-5-(4-methylnaphthalen-1-yl)phenol
CID 53405298
2-chloro-4-hydroxy-3-methoxy-6-methylbenzaldehyde
CID 105453176

Frequently Asked Questions

What is the IUPAC name of ethane;1-methoxy-4-methylnaphthalen-2-ol?
The IUPAC name of ethane;1-methoxy-4-methylnaphthalen-2-ol (CID 142864573) is ethane;1-methoxy-4-methylnaphthalen-2-ol.
What is the SMILES notation for ethane;1-methoxy-4-methylnaphthalen-2-ol?
The canonical SMILES for ethane;1-methoxy-4-methylnaphthalen-2-ol is CC.COc1c(O)cc(C)c2ccccc12.
What is the InChIKey of ethane;1-methoxy-4-methylnaphthalen-2-ol?
The InChIKey is WGGOZAQFJTWQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O2.C2H6/c1-8-7-11(13)12(14-2)10-6-4-3-5-9(8)10;1-2/h3-7,13H,1-2H3;1-2H3.
What are the key properties of ethane;1-methoxy-4-methylnaphthalen-2-ol?
ethane;1-methoxy-4-methylnaphthalen-2-ol has a molecular weight of 218.30 g/mol, XLogP of 3.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methoxy-4-methylnaphthalen-2-ol is sourced from PubChem (CID 142864573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).