6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene

C13H24 — CID 123651388

IUPAC6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene
SMILESC=CC(C)CC(=C)C(CC)C(C)C
InChIInChI=1S/C13H24/c1-7-11(5)9-12(6)13(8-2)10(3)4/h7,10-11,13H,1,6,8-9H2,2-5H3
InChIKeyJYGRPVUJAOVSQO-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.44
Rot. Bonds6

About 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene

6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene (PubChem CID 123651388) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene.

Molecular Properties

Compound Name6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene
PubChem CID123651388
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Name6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene
SMILESC=CC(C)CC(=C)C(CC)C(C)C
InChIInChI=1S/C13H24/c1-7-11(5)9-12(6)13(8-2)10(3)4/h7,10-11,13H,1,6,8-9H2,2-5H3
InChIKeyJYGRPVUJAOVSQO-UHFFFAOYSA-N
XLogP4.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.44
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

3,6-dimethyl-5-methylidenehept-1-ene
CID 91477493
ethane;3-ethyl-4-methylpent-1-en-2-amine
CID 143289250
ethyl (3R)-3-methylpent-4-enoate
CID 173481995
3-ethyl-N,N,4-trimethylpent-1-en-2-amine
CID 139427146
4-ethyl-2,3-dimethylhexa-1,5-diene
CID 54442334
3-ethyl-N-ethynyl-2,2,6-trimethyloct-7-en-4-imine
CID 137412467
3,5,6-trimethyloct-1-ene
CID 90839581
(3Z)-4-ethenyl-6-methylocta-1,3,7-triene
CID 145342446
4-methylidene-3-propan-2-ylhept-1-ene
CID 123221748
N,N,3-trimethylpent-4-enamide
CID 10654310
3,4-diethyl-5-methylhex-1-ene
CID 22107333
3-ethyl-2,6-dimethyl-4-propan-2-ylhept-1-ene
CID 123194726

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene?
The IUPAC name of 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene (CID 123651388) is 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene.
What is the SMILES notation for 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene?
The canonical SMILES for 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene is C=CC(C)CC(=C)C(CC)C(C)C.
What is the InChIKey of 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene?
The InChIKey is JYGRPVUJAOVSQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24/c1-7-11(5)9-12(6)13(8-2)10(3)4/h7,10-11,13H,1,6,8-9H2,2-5H3.
What are the key properties of 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene?
6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene has a molecular weight of 180.33 g/mol, XLogP of 4.44, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3,7-dimethyl-5-methylideneoct-1-ene is sourced from PubChem (CID 123651388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).