2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene

C18H20 — CID 20500094

IUPAC2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene
SMILESCc1ccc2cc(C3=CCC(C)CC3)ccc2c1
InChIInChI=1S/C18H20/c1-13-3-6-15(7-4-13)17-10-9-16-11-14(2)5-8-18(16)12-17/h5-6,8-13H,3-4,7H2,1-2H3
InChIKeyXQWDEGZYUWHISZ-UHFFFAOYSA-N
MW236.36 g/mol
LogP5.35
Rot. Bonds1

About 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene

2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene (PubChem CID 20500094) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene.

Molecular Properties

Compound Name2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene
PubChem CID20500094
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene
SMILESCc1ccc2cc(C3=CCC(C)CC3)ccc2c1
InChIInChI=1S/C18H20/c1-13-3-6-15(7-4-13)17-10-9-16-11-14(2)5-8-18(16)12-17/h5-6,8-13H,3-4,7H2,1-2H3
InChIKeyXQWDEGZYUWHISZ-UHFFFAOYSA-N
XLogP5.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.36
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene?
The IUPAC name of 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene (CID 20500094) is 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene.
What is the SMILES notation for 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene?
The canonical SMILES for 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene is Cc1ccc2cc(C3=CCC(C)CC3)ccc2c1.
What is the InChIKey of 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene?
The InChIKey is XQWDEGZYUWHISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-13-3-6-15(7-4-13)17-10-9-16-11-14(2)5-8-18(16)12-17/h5-6,8-13H,3-4,7H2,1-2H3.
What are the key properties of 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene?
2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene has a molecular weight of 236.36 g/mol, XLogP of 5.35, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(4-methylcyclohexen-1-yl)naphthalene is sourced from PubChem (CID 20500094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).