5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene

C17H22 — CID 156799822

IUPAC5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene
SMILESC=Cc1c(C=C(C)C)c(C)cc2c1CCCC2
InChIInChI=1S/C17H22/c1-5-15-16-9-7-6-8-14(16)11-13(4)17(15)10-12(2)3/h5,10-11H,1,6-9H2,2-4H3
InChIKeyHAUFPZNVNNSTHJ-UHFFFAOYSA-N
MW226.36 g/mol
LogP4.94
Rot. Bonds2

About 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene

5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 156799822) has the molecular formula C17H22 and a molecular weight of 226.36 g/mol. Its IUPAC name is 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID156799822
Molecular FormulaC17H22
Molecular Weight226.36 g/mol
Exact Mass226.17
IUPAC Name5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene
SMILESC=Cc1c(C=C(C)C)c(C)cc2c1CCCC2
InChIInChI=1S/C17H22/c1-5-15-16-9-7-6-8-14(16)11-13(4)17(15)10-12(2)3/h5,10-11H,1,6-9H2,2-4H3
InChIKeyHAUFPZNVNNSTHJ-UHFFFAOYSA-N
XLogP4.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene (CID 156799822) is 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene is C=Cc1c(C=C(C)C)c(C)cc2c1CCCC2.
What is the InChIKey of 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is HAUFPZNVNNSTHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22/c1-5-15-16-9-7-6-8-14(16)11-13(4)17(15)10-12(2)3/h5,10-11H,1,6-9H2,2-4H3.
What are the key properties of 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene?
5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 226.36 g/mol, XLogP of 4.94, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-7-methyl-6-(2-methylprop-1-enyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 156799822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).