(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol

C13H18O2 — CID 105459158

IUPAC(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
SMILESCOC1(CO)CCCc2c(C)cccc21
InChIInChI=1S/C13H18O2/c1-10-5-3-7-12-11(10)6-4-8-13(12,9-14)15-2/h3,5,7,14H,4,6,8-9H2,1-2H3
InChIKeyRYEZOQUOMYCHOO-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.17
Rot. Bonds2

About (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol

(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol (PubChem CID 105459158) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol.

Molecular Properties

Compound Name(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
PubChem CID105459158
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
SMILESCOC1(CO)CCCc2c(C)cccc21
InChIInChI=1S/C13H18O2/c1-10-5-3-7-12-11(10)6-4-8-13(12,9-14)15-2/h3,5,7,14H,4,6,8-9H2,1-2H3
InChIKeyRYEZOQUOMYCHOO-UHFFFAOYSA-N
XLogP2.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(hydroxymethyl)-5-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 105446199
1-hydroxy-5-methyl-3,4-dihydro-2H-naphthalene-1-carboxylic acid
CID 83908872
(2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol
CID 105459152
8-methylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxylic acid
CID 105469834
4-fluoro-8-methyl-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene
CID 84736314
methyl 2-[5-methyl-1-(4-oxobutyl)-3,4-dihydro-2H-naphthalen-1-yl]acetate
CID 167093111
2-(2-methoxy-8-methyl-3,4-dihydro-1H-naphthalen-2-yl)acetic acid
CID 105494487
5-methylspiro[3,4-dihydro-2H-naphthalene-1,1'-cyclohexane]-2-carboxylic acid
CID 115057106
7-methylspiro[1,2-dihydroindene-3,2'-oxetane]
CID 84618324
5-fluoro-1-(methoxymethyl)-3,4-dihydro-2H-naphthalen-1-ol
CID 105464045
7-methylspiro[1,2-dihydroisoindole-3,1'-cyclopropane]
CID 115012488
[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 66058133

Frequently Asked Questions

What is the IUPAC name of (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The IUPAC name of (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol (CID 105459158) is (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol.
What is the SMILES notation for (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The canonical SMILES for (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol is COC1(CO)CCCc2c(C)cccc21.
What is the InChIKey of (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The InChIKey is RYEZOQUOMYCHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-10-5-3-7-12-11(10)6-4-8-13(12,9-14)15-2/h3,5,7,14H,4,6,8-9H2,1-2H3.
What are the key properties of (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol?
(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol has a molecular weight of 206.28 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol is sourced from PubChem (CID 105459158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).