4-methyl-3-methylidenedecane

C12H24 — CID 123290966

IUPAC4-methyl-3-methylidenedecane
SMILESC=C(CC)C(C)CCCCCC
InChIInChI=1S/C12H24/c1-5-7-8-9-10-12(4)11(3)6-2/h12H,3,5-10H2,1-2,4H3
InChIKeyJEKNYBBPRMHKOF-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.56
Rot. Bonds7

About 4-methyl-3-methylidenedecane

4-methyl-3-methylidenedecane (PubChem CID 123290966) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 4-methyl-3-methylidenedecane.

Molecular Properties

Compound Name4-methyl-3-methylidenedecane
PubChem CID123290966
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name4-methyl-3-methylidenedecane
SMILESC=C(CC)C(C)CCCCCC
InChIInChI=1S/C12H24/c1-5-7-8-9-10-12(4)11(3)6-2/h12H,3,5-10H2,1-2,4H3
InChIKeyJEKNYBBPRMHKOF-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(4R)-4-methyl-3-methylideneoctane
CID 10820618
2,3-dimethyldodec-1-ene;ethane;ethene
CID 144958915
3-methylundecan-2-one
CID 12634600
2,3,4-trimethylhexadec-2-ene
CID 90705633
4-methyl-5-methylidenenonane
CID 123995801
3-methyltridecan-2-one
CID 58341645
3-methyloctadecan-2-one
CID 89177698
decane;ethene;hexane;2-methylheptane;2-methylprop-1-ene;nonane
CID 172567112
heptane;2-methylheptadecanoic acid
CID 175511035
2-methyl-3-methylidene-N-propan-2-yldecan-4-amine
CID 134583641
tetratetracontan-22-ol
CID 91434437
nonacosane-7,20-diol
CID 174949468

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-methylidenedecane?
The IUPAC name of 4-methyl-3-methylidenedecane (CID 123290966) is 4-methyl-3-methylidenedecane.
What is the SMILES notation for 4-methyl-3-methylidenedecane?
The canonical SMILES for 4-methyl-3-methylidenedecane is C=C(CC)C(C)CCCCCC.
What is the InChIKey of 4-methyl-3-methylidenedecane?
The InChIKey is JEKNYBBPRMHKOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-5-7-8-9-10-12(4)11(3)6-2/h12H,3,5-10H2,1-2,4H3.
What are the key properties of 4-methyl-3-methylidenedecane?
4-methyl-3-methylidenedecane has a molecular weight of 168.32 g/mol, XLogP of 4.56, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-methylidenedecane is sourced from PubChem (CID 123290966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).