(3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene

C13H22 — CID 144579667

IUPAC(3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene
SMILESC=C/C=C\C(=C/C)[C@H](C)CCCC
InChIInChI=1S/C13H22/c1-5-8-10-12(4)13(7-3)11-9-6-2/h6-7,9,11-12H,2,5,8,10H2,1,3-4H3/b11-9-,13-7+/t12-/m1/s1
InChIKeyBMGOAQQPZICGMT-FWNQILSTSA-N
MW178.32 g/mol
LogP4.50
Rot. Bonds6

About (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene

(3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene (PubChem CID 144579667) has the molecular formula C13H22 and a molecular weight of 178.32 g/mol. Its IUPAC name is (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene.

Molecular Properties

Compound Name(3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene
PubChem CID144579667
Molecular FormulaC13H22
Molecular Weight178.32 g/mol
Exact Mass178.17
IUPAC Name(3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene
SMILESC=C/C=C\C(=C/C)[C@H](C)CCCC
InChIInChI=1S/C13H22/c1-5-8-10-12(4)13(7-3)11-9-6-2/h6-7,9,11-12H,2,5,8,10H2,1,3-4H3/b11-9-,13-7+/t12-/m1/s1
InChIKeyBMGOAQQPZICGMT-FWNQILSTSA-N
XLogP4.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.32
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z,5Z)-6-methyl-5-prop-2-enylidenedec-3-ene
CID 144893155
(3Z,5E)-5-hexan-2-yloxyhepta-1,3,5-triene
CID 144808222
(3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene
CID 144599508
ethane;methane;(3Z,5Z)-5-propan-2-ylhepta-1,3,5-triene
CID 144723819
5-methylnona-1,3-diene
CID 90893682
ethane;(2Z,4Z)-7-methyl-6-methylideneundeca-2,4-diene
CID 167457633
(3E)-3-ethylidene-N-methyloct-1-en-4-amine
CID 129132264
(3Z,5Z)-5-propan-2-ylocta-1,3,5-triene
CID 143760343
(4Z)-4-ethylidene-5-methylnonane
CID 142307818
5,6,7-trimethylnona-1,3,5-triene
CID 123607192
5,6-dimethyldeca-2,4-diene
CID 91470784
(3Z,5Z)-5-ethylidenedodeca-1,3-diene
CID 143713569

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene?
The IUPAC name of (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene (CID 144579667) is (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene.
What is the SMILES notation for (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene?
The canonical SMILES for (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene is C=C/C=C\C(=C/C)[C@H](C)CCCC.
What is the InChIKey of (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene?
The InChIKey is BMGOAQQPZICGMT-FWNQILSTSA-N. The full InChI is InChI=1S/C13H22/c1-5-8-10-12(4)13(7-3)11-9-6-2/h6-7,9,11-12H,2,5,8,10H2,1,3-4H3/b11-9-,13-7+/t12-/m1/s1.
What are the key properties of (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene?
(3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene has a molecular weight of 178.32 g/mol, XLogP of 4.50, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene is sourced from PubChem (CID 144579667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).