(5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene

C13H16 — CID 145127777

IUPAC(5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene
SMILESC/C=C\C(C)=c1\cccc\c1=C\C
InChIInChI=1S/C13H16/c1-4-8-11(3)13-10-7-6-9-12(13)5-2/h4-10H,1-3H3/b8-4-,12-5-,13-11-
InChIKeyCFJAHJHYAQNEPE-NMXCZANKSA-N
MW172.27 g/mol
LogP2.23
Rot. Bonds1

About (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene

(5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene (PubChem CID 145127777) has the molecular formula C13H16 and a molecular weight of 172.27 g/mol. Its IUPAC name is (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene.

Molecular Properties

Compound Name(5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene
PubChem CID145127777
Molecular FormulaC13H16
Molecular Weight172.27 g/mol
Exact Mass172.13
IUPAC Name(5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene
SMILESC/C=C\C(C)=c1\cccc\c1=C\C
InChIInChI=1S/C13H16/c1-4-8-11(3)13-10-7-6-9-12(13)5-2/h4-10H,1-3H3/b8-4-,12-5-,13-11-
InChIKeyCFJAHJHYAQNEPE-NMXCZANKSA-N
XLogP2.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine
CID 144667223
(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane
CID 123449612
(1E)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]propane-1-thiol
CID 137427905
(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;(2Z,4Z)-hexa-2,4-diene;methane
CID 161028149
(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methanamine
CID 88997175
(5Z,6Z)-5-ethylidene-6-[(E)-2-methylpent-2-enylidene]cyclohexa-1,3-diene
CID 162733287
5,6-di(propan-2-ylidene)cyclohexa-1,3-diene;ethane
CID 143829864
(2E,3E,5Z,7E)-7-methyl-2-(6-methylidenecyclohexa-2,4-dien-1-ylidene)nona-3,5,7-triene-4-thiol
CID 166826356
2-(1-anilinoethylidene)pent-3-enoic acid
CID 141217041
[(4E)-3-methylhexa-1,2,4-trienyl]benzene
CID 53467438
dichloro-[(2E,4Z)-hexa-2,4-dien-3-yl]-phenylsilane
CID 163444493
1-methyl-2-[(2E,4Z)-3-methylhexa-2,4-dien-2-yl]benzene
CID 142414325

Frequently Asked Questions

What is the IUPAC name of (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene?
The IUPAC name of (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene (CID 145127777) is (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene.
What is the SMILES notation for (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene?
The canonical SMILES for (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene is C/C=C\C(C)=c1\cccc\c1=C\C.
What is the InChIKey of (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene?
The InChIKey is CFJAHJHYAQNEPE-NMXCZANKSA-N. The full InChI is InChI=1S/C13H16/c1-4-8-11(3)13-10-7-6-9-12(13)5-2/h4-10H,1-3H3/b8-4-,12-5-,13-11-.
What are the key properties of (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene?
(5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene has a molecular weight of 172.27 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene is sourced from PubChem (CID 145127777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).