2,8-dimethyl-5-methylidenenonane

C12H24 — CID 545812

IUPAC2,8-dimethyl-5-methylidenenonane
SMILESC=C(CCC(C)C)CCC(C)C
InChIInChI=1S/C12H24/c1-10(2)6-8-12(5)9-7-11(3)4/h10-11H,5-9H2,1-4H3
InChIKeySLPBMZNHLNJPER-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.41
Rot. Bonds6

About 2,8-dimethyl-5-methylidenenonane

2,8-dimethyl-5-methylidenenonane (PubChem CID 545812) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 2,8-dimethyl-5-methylidenenonane.

Molecular Properties

Compound Name2,8-dimethyl-5-methylidenenonane
PubChem CID545812
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name2,8-dimethyl-5-methylidenenonane
SMILESC=C(CCC(C)C)CCC(C)C
InChIInChI=1S/C12H24/c1-10(2)6-8-12(5)9-7-11(3)4/h10-11H,5-9H2,1-4H3
InChIKeySLPBMZNHLNJPER-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.41
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

2-methyl-5-methylideneundecane
CID 54320712
5-methylhex-1-en-2-ylphosphane
CID 143105119
(1S)-7-methyl-4-methylidene-1-(4-propan-2-ylcyclohexyl)octan-1-ol
CID 118287020
8-methyl-4-methylidenenonan-1-amine
CID 134380496
5-methylhex-1-en-2-amine;molecular hydrogen
CID 142092760
2-(difluoromethyl)-5-methylhex-1-ene
CID 162606646
5-methyl-N-(2-methylpropyl)hex-1-en-2-amine
CID 153336288
2,6-dimethyl-3-methylideneheptan-2-amine
CID 135224839
9-methyl-6-methylidenedecan-5-one
CID 139998322
2,8-dimethyl-4-methylidenenonan-5-one
CID 121008739
2,8-dimethylnon-1-en-5-one
CID 114473507
N-ethyl-N,5-dimethylhex-1-en-2-amine
CID 89100834

Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-5-methylidenenonane?
The IUPAC name of 2,8-dimethyl-5-methylidenenonane (CID 545812) is 2,8-dimethyl-5-methylidenenonane.
What is the SMILES notation for 2,8-dimethyl-5-methylidenenonane?
The canonical SMILES for 2,8-dimethyl-5-methylidenenonane is C=C(CCC(C)C)CCC(C)C.
What is the InChIKey of 2,8-dimethyl-5-methylidenenonane?
The InChIKey is SLPBMZNHLNJPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-10(2)6-8-12(5)9-7-11(3)4/h10-11H,5-9H2,1-4H3.
What are the key properties of 2,8-dimethyl-5-methylidenenonane?
2,8-dimethyl-5-methylidenenonane has a molecular weight of 168.32 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-5-methylidenenonane is sourced from PubChem (CID 545812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).