(2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide

C12H19I — CID 143788216

IUPAC(2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide
SMILESC=C(/C=C\C(=C)C(C)C)/C=C/C.I
InChIInChI=1S/C12H18.HI/c1-6-7-11(4)8-9-12(5)10(2)3;/h6-10H,4-5H2,1-3H3;1H/b7-6+,9-8-;
InChIKeyWPPOSJOENUJISK-CUOMSEFISA-N
MW290.19 g/mol
LogP4.51
Rot. Bonds4

About (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide

(2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide (PubChem CID 143788216) has the molecular formula C12H19I and a molecular weight of 290.19 g/mol. Its IUPAC name is (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide.

Molecular Properties

Compound Name(2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide
PubChem CID143788216
Molecular FormulaC12H19I
Molecular Weight290.19 g/mol
Exact Mass290.05
IUPAC Name(2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide
SMILESC=C(/C=C\C(=C)C(C)C)/C=C/C.I
InChIInChI=1S/C12H18.HI/c1-6-7-11(4)8-9-12(5)10(2)3;/h6-10H,4-5H2,1-3H3;1H/b7-6+,9-8-;
InChIKeyWPPOSJOENUJISK-CUOMSEFISA-N
XLogP4.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.19
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

7-methyl-4-methylideneocta-2,5-diene
CID 123740192
(Z)-7-methyl-3,6-dimethylideneoct-4-en-1-yne
CID 145388588
(3Z,7Z)-2,10-dimethyl-5,6,9-trimethylideneundeca-1,3,7-triene;ethane
CID 143250698
(3E)-N,6-dimethyl-5-methylidene-3-[(Z)-prop-1-enyl]hepta-1,3-dien-2-amine
CID 134267284
(2Z,5Z)-N,8-dimethyl-7-methylidene-3-propan-2-ylnona-2,5-dien-4-imine;ethane
CID 166146875
(3E,5Z)-8-methyl-7-methylidenenona-1,3,5-trien-4-amine
CID 144536498
(Z)-2,7-dimethyl-3,6-dimethylidenedec-4-ene;propane
CID 166116853
(1Z,3Z,6E)-5-methylideneocta-1,3,6-trien-1-amine
CID 89470665
(Z)-5-methyl-4-methylidenehept-2-ene
CID 142042502
O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine
CID 147805987
(2E,4E)-N,7-dimethyl-6-methylidene-N-propan-2-yl-2-[(Z)-prop-1-enyl]octa-2,4-dien-1-amine
CID 139307934
ethane;(3Z)-6-methyl-5-methylidenehepta-1,3-diene;yttrium
CID 177140629

Frequently Asked Questions

What is the IUPAC name of (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide?
The IUPAC name of (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide (CID 143788216) is (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide.
What is the SMILES notation for (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide?
The canonical SMILES for (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide is C=C(/C=C\C(=C)C(C)C)/C=C/C.I.
What is the InChIKey of (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide?
The InChIKey is WPPOSJOENUJISK-CUOMSEFISA-N. The full InChI is InChI=1S/C12H18.HI/c1-6-7-11(4)8-9-12(5)10(2)3;/h6-10H,4-5H2,1-3H3;1H/b7-6+,9-8-;.
What are the key properties of (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide?
(2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide has a molecular weight of 290.19 g/mol, XLogP of 4.51, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide is sourced from PubChem (CID 143788216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).