4-methylcyclohexene;propane

C10H20 — CID 143195942

IUPAC4-methylcyclohexene;propane
SMILESCC1CC=CCC1.CCC
InChIInChI=1S/C7H12.C3H8/c1-7-5-3-2-4-6-7;1-3-2/h2-3,7H,4-6H2,1H3;3H2,1-2H3
InChIKeyCKENKRWJQFNTCA-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds

About 4-methylcyclohexene;propane

4-methylcyclohexene;propane (PubChem CID 143195942) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 4-methylcyclohexene;propane.

Molecular Properties

Compound Name4-methylcyclohexene;propane
PubChem CID143195942
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name4-methylcyclohexene;propane
SMILESCC1CC=CCC1.CCC
InChIInChI=1S/C7H12.C3H8/c1-7-5-3-2-4-6-7;1-3-2/h2-3,7H,4-6H2,1H3;3H2,1-2H3
InChIKeyCKENKRWJQFNTCA-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.78
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

ethane;4-methylcycloheptene
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CID 518777
5-methylcyclononene
CID 524408
(5S)-3-deuterio-5-methylcyclohexene
CID 10606702
N,N-diethylcyclohex-3-en-1-amine
CID 10953728
(1Z)-5-methylcycloundecene
CID 22177383
(6Z)-4-methyl-1-oxacyclopentadec-6-ene
CID 67429404
1-cyclohex-3-en-1-ylazetidine;ethane;propane
CID 145406615
(4S)-4-[(2S)-butan-2-yl]cyclohexene
CID 175915978
ethane;4-methylcyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene
CID 143245192
11-(2,3-dimethylbutan-2-yl)-4-methylcyclotridecene
CID 123568593

Frequently Asked Questions

What is the IUPAC name of 4-methylcyclohexene;propane?
The IUPAC name of 4-methylcyclohexene;propane (CID 143195942) is 4-methylcyclohexene;propane.
What is the SMILES notation for 4-methylcyclohexene;propane?
The canonical SMILES for 4-methylcyclohexene;propane is CC1CC=CCC1.CCC.
What is the InChIKey of 4-methylcyclohexene;propane?
The InChIKey is CKENKRWJQFNTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12.C3H8/c1-7-5-3-2-4-6-7;1-3-2/h2-3,7H,4-6H2,1H3;3H2,1-2H3.
What are the key properties of 4-methylcyclohexene;propane?
4-methylcyclohexene;propane has a molecular weight of 140.27 g/mol, XLogP of 3.78, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylcyclohexene;propane is sourced from PubChem (CID 143195942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).