2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol

C15H20O2 — CID 86028923

IUPAC2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol
SMILESCOc1ccc2c(c1)C(C)(C)CC=C2CCO
InChIInChI=1S/C15H20O2/c1-15(2)8-6-11(7-9-16)13-5-4-12(17-3)10-14(13)15/h4-6,10,16H,7-9H2,1-3H3
InChIKeyFRVRTPWETJILSE-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.14
Rot. Bonds3

About 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol

2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol (PubChem CID 86028923) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol.

Molecular Properties

Compound Name2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol
PubChem CID86028923
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol
SMILESCOc1ccc2c(c1)C(C)(C)CC=C2CCO
InChIInChI=1S/C15H20O2/c1-15(2)8-6-11(7-9-16)13-5-4-12(17-3)10-14(13)15/h4-6,10,16H,7-9H2,1-3H3
InChIKeyFRVRTPWETJILSE-UHFFFAOYSA-N
XLogP3.14
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-methoxy-1,1,4-trimethyl-2H-naphthalene
CID 20646489
2-[(1R)-7-methoxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]ethanol
CID 11775651
4-iodo-7-methoxy-3,3-dimethyl-2H-cyclopenta[a]indene
CID 102100246
6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol
CID 102335151
7-fluoro-2-methoxy-10,10-dimethyl-9H-phenanthrene
CID 175802586
2-[4-(2-amino-4-methoxyphenoxy)phenyl]ethanol
CID 107708398
2-bromo-6-methoxy-4,4-dimethyl-2,3-dihydronaphthalen-1-one
CID 44726409
2-(5-methoxy-2-piperidin-1-ylphenyl)ethanol
CID 117343468
5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene
CID 624568
2-(2-bromo-5-methoxyphenyl)ethanol
CID 10489678
2-(2-chloro-4-methoxyphenyl)ethanol
CID 66697098
2-(3-amino-6-methoxy-1,3-dimethyl-2H-inden-1-yl)acetic acid
CID 23356760

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol?
The IUPAC name of 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol (CID 86028923) is 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol.
What is the SMILES notation for 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol?
The canonical SMILES for 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol is COc1ccc2c(c1)C(C)(C)CC=C2CCO.
What is the InChIKey of 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol?
The InChIKey is FRVRTPWETJILSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-15(2)8-6-11(7-9-16)13-5-4-12(17-3)10-14(13)15/h4-6,10,16H,7-9H2,1-3H3.
What are the key properties of 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol?
2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol has a molecular weight of 232.32 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-4,4-dimethyl-3H-naphthalen-1-yl)ethanol is sourced from PubChem (CID 86028923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).