4-methyl-5-prop-1-enylcyclohexene

C10H16 — CID 123539934

IUPAC4-methyl-5-prop-1-enylcyclohexene
SMILESCC=CC1CC=CCC1C
InChIInChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h3-6,9-10H,7-8H2,1-2H3
InChIKeyHGORYQIUDHEIDE-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.16
Rot. Bonds1

About 4-methyl-5-prop-1-enylcyclohexene

4-methyl-5-prop-1-enylcyclohexene (PubChem CID 123539934) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 4-methyl-5-prop-1-enylcyclohexene.

Molecular Properties

Compound Name4-methyl-5-prop-1-enylcyclohexene
PubChem CID123539934
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name4-methyl-5-prop-1-enylcyclohexene
SMILESCC=CC1CC=CCC1C
InChIInChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h3-6,9-10H,7-8H2,1-2H3
InChIKeyHGORYQIUDHEIDE-UHFFFAOYSA-N
XLogP3.16
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 ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine
CID 130390394
3-(6-methylcyclohex-3-en-1-yl)prop-2-enoic acid
CID 154122429
trans-(1S,2S)-1,2-bis[(E)-prop-1-enyl]cyclopropane
CID 134897688
1,4-dimethyl-2-[(E)-prop-1-enyl]cyclopentane
CID 20661398
5-prop-1-enylbicyclo[2.2.1]hept-1-ene
CID 56976847
(1S)-2-[(Z)-prop-1-enyl]cyclohexane-1-carbaldehyde
CID 173500000
cis-(1S,2R)-2-[(E)-prop-1-enyl]cyclopropane-1-carboxylic acid
CID 90666534
4-methyl-5-[(E)-prop-1-enyl]oxan-2-one
CID 89207970
5-methylcyclopent-2-ene-1-carbaldehyde
CID 75994699
(1R,6S)-N,6-dimethylcyclohex-3-en-1-amine
CID 177020331
(5R)-4-ethyl-5-methylcyclohexene
CID 154516565
(6S)-6-formylcyclohex-3-ene-1-carboxylic acid
CID 142182365

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-prop-1-enylcyclohexene?
The IUPAC name of 4-methyl-5-prop-1-enylcyclohexene (CID 123539934) is 4-methyl-5-prop-1-enylcyclohexene.
What is the SMILES notation for 4-methyl-5-prop-1-enylcyclohexene?
The canonical SMILES for 4-methyl-5-prop-1-enylcyclohexene is CC=CC1CC=CCC1C.
What is the InChIKey of 4-methyl-5-prop-1-enylcyclohexene?
The InChIKey is HGORYQIUDHEIDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-3-6-10-8-5-4-7-9(10)2/h3-6,9-10H,7-8H2,1-2H3.
What are the key properties of 4-methyl-5-prop-1-enylcyclohexene?
4-methyl-5-prop-1-enylcyclohexene has a molecular weight of 136.24 g/mol, XLogP of 3.16, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-prop-1-enylcyclohexene is sourced from PubChem (CID 123539934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).