2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene

C15H20O — CID 582364

IUPAC2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene
SMILESC=C(C)CC1c2ccccc2CCC1OC
InChIInChI=1S/C15H20O/c1-11(2)10-14-13-7-5-4-6-12(13)8-9-15(14)16-3/h4-7,14-15H,1,8-10H2,2-3H3
InChIKeyTVRXVJVSJLAMJC-UHFFFAOYSA-N
MW216.32 g/mol
LogP3.70
Rot. Bonds3

About 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene

2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 582364) has the molecular formula C15H20O and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID582364
Molecular FormulaC15H20O
Molecular Weight216.32 g/mol
Exact Mass216.15
IUPAC Name2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene
SMILESC=C(C)CC1c2ccccc2CCC1OC
InChIInChI=1S/C15H20O/c1-11(2)10-14-13-7-5-4-6-12(13)8-9-15(14)16-3/h4-7,14-15H,1,8-10H2,2-3H3
InChIKeyTVRXVJVSJLAMJC-UHFFFAOYSA-N
XLogP3.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1R,2S)-2-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 118421434
methyl 2-(2-trimethylsilyloxy-1,2,3,4-tetrahydronaphthalen-1-yl)acetate
CID 582013
N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine
CID 134049939
1-[3-(2-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]-4-phenylpiperazine
CID 67806462
1-(2,3-dihydro-1H-inden-1-yl)-4-methylpent-4-en-1-ol
CID 114473913
N-[(1R,2S)-2-(methoxymethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 134952452
(1S,2S)-1-ethyl-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 163236306
N-(2-methoxycyclopentyl)-2,3-dihydro-1H-inden-1-amine
CID 62086936
[(1S,2S)-1-methylsulfanyl-1,2,3,4-tetrahydronaphthalen-2-yl] acetate
CID 168894723
methyl (1S,2S)-2-hydroxy-1,2,3,4-tetrahydronaphthalene-1-carboxylate
CID 102001294
tris(2,3-dihydro-1H-inden-1-ol);ethane
CID 19770523
[(1R)-2,3-dihydro-1H-inden-1-yl]methyl acetate
CID 129405873

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene (CID 582364) is 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene is C=C(C)CC1c2ccccc2CCC1OC.
What is the InChIKey of 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is TVRXVJVSJLAMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O/c1-11(2)10-14-13-7-5-4-6-12(13)8-9-15(14)16-3/h4-7,14-15H,1,8-10H2,2-3H3.
What are the key properties of 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene?
2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 216.32 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-methylprop-2-enyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 582364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).