(2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol

C18H30O — CID 142271030

IUPAC(2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol
SMILESC=C(/C=C\C(C)=C(/C)O)CCC1CCCC(CC)C1
InChIInChI=1S/C18H30O/c1-5-17-7-6-8-18(13-17)12-10-14(2)9-11-15(3)16(4)19/h9,11,17-19H,2,5-8,10,12-13H2,1,3-4H3/b11-9-,16-15+
InChIKeyUKKHYKGSMUVDRG-ABDGSJBQSA-N
MW262.44 g/mol
LogP5.95
Rot. Bonds6

About (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol

(2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol (PubChem CID 142271030) has the molecular formula C18H30O and a molecular weight of 262.44 g/mol. Its IUPAC name is (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol.

Molecular Properties

Compound Name(2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol
PubChem CID142271030
Molecular FormulaC18H30O
Molecular Weight262.44 g/mol
Exact Mass262.23
IUPAC Name(2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol
SMILESC=C(/C=C\C(C)=C(/C)O)CCC1CCCC(CC)C1
InChIInChI=1S/C18H30O/c1-5-17-7-6-8-18(13-17)12-10-14(2)9-11-15(3)16(4)19/h9,11,17-19H,2,5-8,10,12-13H2,1,3-4H3/b11-9-,16-15+
InChIKeyUKKHYKGSMUVDRG-ABDGSJBQSA-N
XLogP5.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.44
LogP ≤ 55.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-3-propylcyclohexane
CID 22129036
1-(3-ethylcyclohexyl)-4,4-dimethylpentan-3-one
CID 64503603
[(1S,3R)-3-ethylcyclohexyl]methanol
CID 14940078
ethylcyclobutane;tris(2-methylprop-2-enoic acid)
CID 67802354
4-(3-ethylcyclohexyl)butan-2-ol
CID 64515545
3-[5-(3-ethylcyclohexyl)pentyl]cyclohexane-1-carbaldehyde
CID 88959977
N-[(3-ethylcyclohexyl)methyl]acetamide
CID 59811764
1-(2-cyclobutylethyl)-3-ethylcyclobutane
CID 123886657
1-(3-ethylcyclopentyl)pentan-3-one
CID 122412950
1-(3-ethylcyclohexyl)butan-2-ol
CID 79424228
1,3-dipentylcyclohexane
CID 54105663
(2R)-2-amino-3-(3-ethylcyclohexyl)propanoic acid
CID 167112853

Frequently Asked Questions

What is the IUPAC name of (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol?
The IUPAC name of (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol (CID 142271030) is (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol.
What is the SMILES notation for (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol?
The canonical SMILES for (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol is C=C(/C=C\C(C)=C(/C)O)CCC1CCCC(CC)C1.
What is the InChIKey of (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol?
The InChIKey is UKKHYKGSMUVDRG-ABDGSJBQSA-N. The full InChI is InChI=1S/C18H30O/c1-5-17-7-6-8-18(13-17)12-10-14(2)9-11-15(3)16(4)19/h9,11,17-19H,2,5-8,10,12-13H2,1,3-4H3/b11-9-,16-15+.
What are the key properties of (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol?
(2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol has a molecular weight of 262.44 g/mol, XLogP of 5.95, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z)-8-(3-ethylcyclohexyl)-3-methyl-6-methylideneocta-2,4-dien-2-ol is sourced from PubChem (CID 142271030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).