1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene

C24H30O — CID 70422916

IUPAC1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene
SMILESCC=CC(C)(OC(C)(C=CC)c1ccccc1C)c1ccccc1C
InChIInChI=1S/C24H30O/c1-7-17-23(5,21-15-11-9-13-19(21)3)25-24(6,18-8-2)22-16-12-10-14-20(22)4/h7-18H,1-6H3
InChIKeyULRANVSDRPTUIE-UHFFFAOYSA-N
MW334.50 g/mol
LogP6.60
Rot. Bonds6

About 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene

1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene (PubChem CID 70422916) has the molecular formula C24H30O and a molecular weight of 334.50 g/mol. Its IUPAC name is 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene.

Molecular Properties

Compound Name1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene
PubChem CID70422916
Molecular FormulaC24H30O
Molecular Weight334.50 g/mol
Exact Mass334.23
IUPAC Name1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene
SMILESCC=CC(C)(OC(C)(C=CC)c1ccccc1C)c1ccccc1C
InChIInChI=1S/C24H30O/c1-7-17-23(5,21-15-11-9-13-19(21)3)25-24(6,18-8-2)22-16-12-10-14-20(22)4/h7-18H,1-6H3
InChIKeyULRANVSDRPTUIE-UHFFFAOYSA-N
XLogP6.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.50
LogP ≤ 56.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene?
The IUPAC name of 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene (CID 70422916) is 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene.
What is the SMILES notation for 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene?
The canonical SMILES for 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene is CC=CC(C)(OC(C)(C=CC)c1ccccc1C)c1ccccc1C.
What is the InChIKey of 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene?
The InChIKey is ULRANVSDRPTUIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30O/c1-7-17-23(5,21-15-11-9-13-19(21)3)25-24(6,18-8-2)22-16-12-10-14-20(22)4/h7-18H,1-6H3.
What are the key properties of 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene?
1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene has a molecular weight of 334.50 g/mol, XLogP of 6.60, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[2-[2-(2-methylphenyl)pent-3-en-2-yloxy]pent-3-en-2-yl]benzene is sourced from PubChem (CID 70422916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).