1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene

C15H20 — CID 163229113

IUPAC1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene
SMILESC=C(/C=C(/C)c1ccccc1C)C(C)C
InChIInChI=1S/C15H20/c1-11(2)13(4)10-14(5)15-9-7-6-8-12(15)3/h6-11H,4H2,1-3,5H3/b14-10-
InChIKeyCRPVTRSTSNTSJX-UVTDQMKNSA-N
MW200.32 g/mol
LogP4.61
Rot. Bonds3

About 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene

1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene (PubChem CID 163229113) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene.

Molecular Properties

Compound Name1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene
PubChem CID163229113
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Name1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene
SMILESC=C(/C=C(/C)c1ccccc1C)C(C)C
InChIInChI=1S/C15H20/c1-11(2)13(4)10-14(5)15-9-7-6-8-12(15)3/h6-11H,4H2,1-3,5H3/b14-10-
InChIKeyCRPVTRSTSNTSJX-UVTDQMKNSA-N
XLogP4.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene?
The IUPAC name of 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene (CID 163229113) is 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene.
What is the SMILES notation for 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene?
The canonical SMILES for 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene is C=C(/C=C(/C)c1ccccc1C)C(C)C.
What is the InChIKey of 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene?
The InChIKey is CRPVTRSTSNTSJX-UVTDQMKNSA-N. The full InChI is InChI=1S/C15H20/c1-11(2)13(4)10-14(5)15-9-7-6-8-12(15)3/h6-11H,4H2,1-3,5H3/b14-10-.
What are the key properties of 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene?
1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene has a molecular weight of 200.32 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(Z)-5-methyl-4-methylidenehex-2-en-2-yl]benzene is sourced from PubChem (CID 163229113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).