6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene

C15H20 — CID 150086405

IUPAC6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene
SMILESC=Cc1cc2c(cc1C)CCCC2(C)C
InChIInChI=1S/C15H20/c1-5-12-10-14-13(9-11(12)2)7-6-8-15(14,3)4/h5,9-10H,1,6-8H2,2-4H3
InChIKeyDSHZMBYTZXFQBQ-UHFFFAOYSA-N
MW200.32 g/mol
LogP4.25
Rot. Bonds1

About 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene

6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene (PubChem CID 150086405) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene.

Molecular Properties

Compound Name6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene
PubChem CID150086405
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Name6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene
SMILESC=Cc1cc2c(cc1C)CCCC2(C)C
InChIInChI=1S/C15H20/c1-5-12-10-14-13(9-11(12)2)7-6-8-15(14,3)4/h5,9-10H,1,6-8H2,2-4H3
InChIKeyDSHZMBYTZXFQBQ-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene?
The IUPAC name of 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene (CID 150086405) is 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene.
What is the SMILES notation for 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene?
The canonical SMILES for 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene is C=Cc1cc2c(cc1C)CCCC2(C)C.
What is the InChIKey of 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene?
The InChIKey is DSHZMBYTZXFQBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20/c1-5-12-10-14-13(9-11(12)2)7-6-8-15(14,3)4/h5,9-10H,1,6-8H2,2-4H3.
What are the key properties of 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene?
6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene has a molecular weight of 200.32 g/mol, XLogP of 4.25, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-4,4,7-trimethyl-2,3-dihydro-1H-naphthalene is sourced from PubChem (CID 150086405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).