3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene

C17H22 — CID 158208659

IUPAC3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene
SMILESC=C1Cc2c(C)c(C)c(C)c(C)c2C(C)=C1C
InChIInChI=1S/C17H22/c1-9-8-16-13(5)11(3)12(4)15(7)17(16)14(6)10(9)2/h1,8H2,2-7H3
InChIKeyXFFFRTVRQSHTKX-UHFFFAOYSA-N
MW226.36 g/mol
LogP4.83
Rot. Bonds

About 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene

3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene (PubChem CID 158208659) has the molecular formula C17H22 and a molecular weight of 226.36 g/mol. Its IUPAC name is 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene.

Molecular Properties

Compound Name3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene
PubChem CID158208659
Molecular FormulaC17H22
Molecular Weight226.36 g/mol
Exact Mass226.17
IUPAC Name3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene
SMILESC=C1Cc2c(C)c(C)c(C)c(C)c2C(C)=C1C
InChIInChI=1S/C17H22/c1-9-8-16-13(5)11(3)12(4)15(7)17(16)14(6)10(9)2/h1,8H2,2-7H3
InChIKeyXFFFRTVRQSHTKX-UHFFFAOYSA-N
XLogP4.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene?
The IUPAC name of 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene (CID 158208659) is 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene.
What is the SMILES notation for 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene?
The canonical SMILES for 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene is C=C1Cc2c(C)c(C)c(C)c(C)c2C(C)=C1C.
What is the InChIKey of 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene?
The InChIKey is XFFFRTVRQSHTKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22/c1-9-8-16-13(5)11(3)12(4)15(7)17(16)14(6)10(9)2/h1,8H2,2-7H3.
What are the key properties of 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene?
3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene has a molecular weight of 226.36 g/mol, XLogP of 4.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,6,7,8-hexamethyl-2-methylidene-1H-naphthalene is sourced from PubChem (CID 158208659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).