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

C13H18O2 — CID 105459152

IUPAC(2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol
SMILESCOC1(CO)CCc2c(C)cccc2C1
InChIInChI=1S/C13H18O2/c1-10-4-3-5-11-8-13(9-14,15-2)7-6-12(10)11/h3-5,14H,6-9H2,1-2H3
InChIKeyFRSSQHQRRADROQ-UHFFFAOYSA-N
MW206.28 g/mol
LogP1.86
Rot. Bonds2

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

(2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol (PubChem CID 105459152) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol.

Molecular Properties

Compound Name(2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol
PubChem CID105459152
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name(2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol
SMILESCOC1(CO)CCc2c(C)cccc2C1
InChIInChI=1S/C13H18O2/c1-10-4-3-5-11-8-13(9-14,15-2)7-6-12(10)11/h3-5,14H,6-9H2,1-2H3
InChIKeyFRSSQHQRRADROQ-UHFFFAOYSA-N
XLogP1.86
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 ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxy-8-methyl-3,4-dihydro-1H-naphthalen-2-yl)acetic acid
CID 105494487
3,3,8-trimethyl-2,4-dihydro-1H-naphthalene
CID 59978113
(2,6-dimethoxy-3,4-dihydro-1H-naphthalen-2-yl)methanol
CID 105479196
(1-methoxy-5-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 105459158
(2,8-dimethoxy-3,4-dihydro-1H-naphthalen-2-yl)methanamine
CID 105477816
2-amino-5-methyl-3,4-dihydro-1H-naphthalene-2-carbonitrile
CID 90713435
2-(2-hydroxy-8-methyl-3,4-dihydro-1H-naphthalen-2-yl)acetic acid
CID 105475613
(2-amino-5-bromo-3,4-dihydro-1H-naphthalen-2-yl)methanol
CID 58466784
2-fluoro-8-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 105461592
(2-amino-5-butyl-3,4-dihydro-1H-naphthalen-2-yl)methanol;hydrochloride
CID 46864780
5-fluoro-2-methoxy-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 105481657
1-(hydroxymethyl)-5-methyl-3,4-dihydro-2H-naphthalen-1-ol
CID 105446199

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol?
The IUPAC name of (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol (CID 105459152) is (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol.
What is the SMILES notation for (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol?
The canonical SMILES for (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol is COC1(CO)CCc2c(C)cccc2C1.
What is the InChIKey of (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol?
The InChIKey is FRSSQHQRRADROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-10-4-3-5-11-8-13(9-14,15-2)7-6-12(10)11/h3-5,14H,6-9H2,1-2H3.
What are the key properties of (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol?
(2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol has a molecular weight of 206.28 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-5-methyl-3,4-dihydro-1H-naphthalen-2-yl)methanol is sourced from PubChem (CID 105459152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).