4-methyl-1-prop-1-en-2-ylcyclohexene

C10H16 — CID 521851

IUPAC4-methyl-1-prop-1-en-2-ylcyclohexene
SMILESC=C(C)C1=CCC(C)CC1
InChIInChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h6,9H,1,4-5,7H2,2-3H3
InChIKeyAJSJXSBFZDIRIS-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.31
Rot. Bonds1

About 4-methyl-1-prop-1-en-2-ylcyclohexene

4-methyl-1-prop-1-en-2-ylcyclohexene (PubChem CID 521851) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 4-methyl-1-prop-1-en-2-ylcyclohexene.

Molecular Properties

Compound Name4-methyl-1-prop-1-en-2-ylcyclohexene
PubChem CID521851
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name4-methyl-1-prop-1-en-2-ylcyclohexene
SMILESC=C(C)C1=CCC(C)CC1
InChIInChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h6,9H,1,4-5,7H2,2-3H3
InChIKeyAJSJXSBFZDIRIS-UHFFFAOYSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-prop-1-en-2-ylcyclohexene?
The IUPAC name of 4-methyl-1-prop-1-en-2-ylcyclohexene (CID 521851) is 4-methyl-1-prop-1-en-2-ylcyclohexene.
What is the SMILES notation for 4-methyl-1-prop-1-en-2-ylcyclohexene?
The canonical SMILES for 4-methyl-1-prop-1-en-2-ylcyclohexene is C=C(C)C1=CCC(C)CC1.
What is the InChIKey of 4-methyl-1-prop-1-en-2-ylcyclohexene?
The InChIKey is AJSJXSBFZDIRIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h6,9H,1,4-5,7H2,2-3H3.
What are the key properties of 4-methyl-1-prop-1-en-2-ylcyclohexene?
4-methyl-1-prop-1-en-2-ylcyclohexene has a molecular weight of 136.24 g/mol, XLogP of 3.31, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-prop-1-en-2-ylcyclohexene is sourced from PubChem (CID 521851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).