2-ethyl-6-methoxy-1,2-dihydronaphthalene

C13H16O — CID 66750543

IUPAC2-ethyl-6-methoxy-1,2-dihydronaphthalene
SMILESCCC1C=Cc2cc(OC)ccc2C1
InChIInChI=1S/C13H16O/c1-3-10-4-5-12-9-13(14-2)7-6-11(12)8-10/h4-7,9-10H,3,8H2,1-2H3
InChIKeyIMSXIYYJKBXISD-UHFFFAOYSA-N
MW188.27 g/mol
LogP3.29
Rot. Bonds2

About 2-ethyl-6-methoxy-1,2-dihydronaphthalene

2-ethyl-6-methoxy-1,2-dihydronaphthalene (PubChem CID 66750543) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-ethyl-6-methoxy-1,2-dihydronaphthalene.

Molecular Properties

Compound Name2-ethyl-6-methoxy-1,2-dihydronaphthalene
PubChem CID66750543
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name2-ethyl-6-methoxy-1,2-dihydronaphthalene
SMILESCCC1C=Cc2cc(OC)ccc2C1
InChIInChI=1S/C13H16O/c1-3-10-4-5-12-9-13(14-2)7-6-11(12)8-10/h4-7,9-10H,3,8H2,1-2H3
InChIKeyIMSXIYYJKBXISD-UHFFFAOYSA-N
XLogP3.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-methoxy-1,2-dihydronaphthalen-2-amine
CID 45091183
3-ethyl-7-methoxy-1,2,3,4-tetrahydroisoquinoline
CID 62375759
3-ethyl-7-methoxy-1-propan-2-yl-1,2,3,4-tetrahydroisoquinoline
CID 83970711
N-ethyl-5-methoxy-N-methyl-2,3-dihydro-1H-inden-2-amine
CID 23397076
5-methoxy-1H-inden-1-amine
CID 82157971
7-methoxy-3-methyl-2-(2-methylphenyl)-3,4-dihydroisoquinolin-2-ium
CID 18691252
2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene
CID 134338473
5-methoxy-2-methyl-1H-indene
CID 12616525
(2R)-5-methoxy-N-methyl-2,3-dihydro-1H-inden-2-amine
CID 86334379
1-(6-methoxy-1H-inden-1-yl)ethanol
CID 90078900
4-(2-butoxyphenyl)-6-methoxy-3,4-dihydro-1H-naphthalen-2-one
CID 157493993
3,6-dimethoxy-1,2-dihydronaphthalene
CID 13364263

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-methoxy-1,2-dihydronaphthalene?
The IUPAC name of 2-ethyl-6-methoxy-1,2-dihydronaphthalene (CID 66750543) is 2-ethyl-6-methoxy-1,2-dihydronaphthalene.
What is the SMILES notation for 2-ethyl-6-methoxy-1,2-dihydronaphthalene?
The canonical SMILES for 2-ethyl-6-methoxy-1,2-dihydronaphthalene is CCC1C=Cc2cc(OC)ccc2C1.
What is the InChIKey of 2-ethyl-6-methoxy-1,2-dihydronaphthalene?
The InChIKey is IMSXIYYJKBXISD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O/c1-3-10-4-5-12-9-13(14-2)7-6-11(12)8-10/h4-7,9-10H,3,8H2,1-2H3.
What are the key properties of 2-ethyl-6-methoxy-1,2-dihydronaphthalene?
2-ethyl-6-methoxy-1,2-dihydronaphthalene has a molecular weight of 188.27 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methoxy-1,2-dihydronaphthalene is sourced from PubChem (CID 66750543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).