5-methyl-6,7-dimethylidenenon-1-ene

C12H20 — CID 142109737

IUPAC5-methyl-6,7-dimethylidenenon-1-ene
SMILESC=CCCC(C)C(=C)C(=C)CC
InChIInChI=1S/C12H20/c1-6-8-9-11(4)12(5)10(3)7-2/h6,11H,1,3,5,7-9H2,2,4H3
InChIKeyDDGPIWIVZPANEE-UHFFFAOYSA-N
MW164.29 g/mol
LogP4.11
Rot. Bonds6

About 5-methyl-6,7-dimethylidenenon-1-ene

5-methyl-6,7-dimethylidenenon-1-ene (PubChem CID 142109737) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is 5-methyl-6,7-dimethylidenenon-1-ene.

Molecular Properties

Compound Name5-methyl-6,7-dimethylidenenon-1-ene
PubChem CID142109737
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name5-methyl-6,7-dimethylidenenon-1-ene
SMILESC=CCCC(C)C(=C)C(=C)CC
InChIInChI=1S/C12H20/c1-6-8-9-11(4)12(5)10(3)7-2/h6,11H,1,3,5,7-9H2,2,4H3
InChIKeyDDGPIWIVZPANEE-UHFFFAOYSA-N
XLogP4.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2R,3S)-hept-6-ene-2,3-diol
CID 102384670
ethane;2-methylbut-1-ene;(3S)-3-methylhepta-1,6-diene
CID 176715177
(3E)-N,5-dimethylnona-3,8-dien-4-amine
CID 138564764
2-methyloct-7-ene-3,4-diol
CID 103456684
bis(buta-1,3-diene);5-methylhex-1-ene
CID 174724270
3,4-dimethylidenehexan-2-ol
CID 130126331
(5R,6S)-dec-1-ene-5,6-diol
CID 10511398
(2S,3S)-3-methylhept-6-ene-1,2-diol
CID 102243304
(5R,6R)-dec-1-ene-5,6-diol
CID 10844929
N-methylpropan-1-amine;3-methyl-N-propylhepta-1,6-dien-2-amine
CID 156713243
3-hydroxy-2-methylhept-6-enal
CID 15601022
(3S)-3-methylhepta-1,6-diene
CID 145257056

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6,7-dimethylidenenon-1-ene?
The IUPAC name of 5-methyl-6,7-dimethylidenenon-1-ene (CID 142109737) is 5-methyl-6,7-dimethylidenenon-1-ene.
What is the SMILES notation for 5-methyl-6,7-dimethylidenenon-1-ene?
The canonical SMILES for 5-methyl-6,7-dimethylidenenon-1-ene is C=CCCC(C)C(=C)C(=C)CC.
What is the InChIKey of 5-methyl-6,7-dimethylidenenon-1-ene?
The InChIKey is DDGPIWIVZPANEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20/c1-6-8-9-11(4)12(5)10(3)7-2/h6,11H,1,3,5,7-9H2,2,4H3.
What are the key properties of 5-methyl-6,7-dimethylidenenon-1-ene?
5-methyl-6,7-dimethylidenenon-1-ene has a molecular weight of 164.29 g/mol, XLogP of 4.11, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6,7-dimethylidenenon-1-ene is sourced from PubChem (CID 142109737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).