2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol

C17H26O3 — CID 19813524

IUPAC2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol
SMILESCOc1cc(C(C)O)c(O)c2c1C(C)(C)CCC2(C)C
InChIInChI=1S/C17H26O3/c1-10(18)11-9-12(20-6)13-14(15(11)19)17(4,5)8-7-16(13,2)3/h9-10,18-19H,7-8H2,1-6H3
InChIKeyGZLIVGIYEBONME-UHFFFAOYSA-N
MW278.39 g/mol
LogP3.80
Rot. Bonds2

About 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol

2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol (PubChem CID 19813524) has the molecular formula C17H26O3 and a molecular weight of 278.39 g/mol. Its IUPAC name is 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol.

Molecular Properties

Compound Name2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol
PubChem CID19813524
Molecular FormulaC17H26O3
Molecular Weight278.39 g/mol
Exact Mass278.19
IUPAC Name2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol
SMILESCOc1cc(C(C)O)c(O)c2c1C(C)(C)CCC2(C)C
InChIInChI=1S/C17H26O3/c1-10(18)11-9-12(20-6)13-14(15(11)19)17(4,5)8-7-16(13,2)3/h9-10,18-19H,7-8H2,1-6H3
InChIKeyGZLIVGIYEBONME-UHFFFAOYSA-N
XLogP3.80
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.39
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 163198569
1-(4,5-dimethoxy-2-propan-2-ylphenyl)ethanol
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1-(2-bromo-4,5-dimethoxyphenyl)ethanol
CID 12605921
methyl 4-hydroxy-3-(1-hydroxyethyl)-5-methoxybenzoate
CID 117325019
1-(4-bromo-3-methoxy-5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)ethanol
CID 22490951
4-chloro-2-(1-hydroxyethyl)-5-methoxyphenol
CID 117291182
1-(4,5-dimethoxy-2-nitrosophenyl)ethanol
CID 88927442
4-chloro-5-(1-hydroxyethyl)-2-methoxyphenol
CID 84671120
1-(3-chloro-2,4,5-trimethoxyphenyl)ethanol
CID 84705859
1-(2,4-dimethoxy-5-methylphenyl)ethanol
CID 84666953
(1R)-1-(4-methoxy-2,5-dimethylphenyl)ethanol
CID 93182220
1-[1-(2-methoxy-5-methylphenyl)cyclopropyl]ethanol
CID 83687634

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol?
The IUPAC name of 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol (CID 19813524) is 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol.
What is the SMILES notation for 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol?
The canonical SMILES for 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol is COc1cc(C(C)O)c(O)c2c1C(C)(C)CCC2(C)C.
What is the InChIKey of 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol?
The InChIKey is GZLIVGIYEBONME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O3/c1-10(18)11-9-12(20-6)13-14(15(11)19)17(4,5)8-7-16(13,2)3/h9-10,18-19H,7-8H2,1-6H3.
What are the key properties of 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol?
2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol has a molecular weight of 278.39 g/mol, XLogP of 3.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxyethyl)-4-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-ol is sourced from PubChem (CID 19813524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).