2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene

C15H18S — CID 123767942

IUPAC2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene
SMILESC=CC=c1c(C=CC)c(C=CC)sc1=CC
InChIInChI=1S/C15H18S/c1-5-9-12-13(10-6-2)15(11-7-3)16-14(12)8-4/h5-11H,1H2,2-4H3
InChIKeyVOWDHUTZKRJXHB-UHFFFAOYSA-N
MW230.38 g/mol
LogP3.58
Rot. Bonds3

About 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene

2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene (PubChem CID 123767942) has the molecular formula C15H18S and a molecular weight of 230.38 g/mol. Its IUPAC name is 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene.

Molecular Properties

Compound Name2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene
PubChem CID123767942
Molecular FormulaC15H18S
Molecular Weight230.38 g/mol
Exact Mass230.11
IUPAC Name2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene
SMILESC=CC=c1c(C=CC)c(C=CC)sc1=CC
InChIInChI=1S/C15H18S/c1-5-9-12-13(10-6-2)15(11-7-3)16-14(12)8-4/h5-11H,1H2,2-4H3
InChIKeyVOWDHUTZKRJXHB-UHFFFAOYSA-N
XLogP3.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,7-Di-tert-butylthiepin
CID 145017
5-[2,3-Bis(tert-butylsulfanyl)cycloprop-2-en-1-ylidene]cyclopenta-1,3-diene
CID 13020089
(2E)-2-[(4E)-5,6-difluoro-2,3-dimethylidenehepta-4,6-dienylidene]-3-methylidene-5-[(E)-prop-1-enyl]thiophene
CID 145203814
(2E)-2-[(4Z)-6-fluoro-2,3-dimethylidenehepta-4,6-dienylidene]-3-methylidene-5-propylthiophene
CID 145203819
(2Z)-3-methylidene-5-propyl-2-[(4E)-1,5,6-trifluoro-2,3-dimethylidenehepta-4,6-dienylidene]thiophene
CID 145203831
(2Z,4E)-5-buta-1,3-dien-2-ylsulfanyl-7-fluoro-7-methyl-6-methylideneocta-2,4-diene
CID 156057037
Ethylfurfuryl sulfide
CID 528326
2,7-Diisopropylthiepin
CID 129654671
2-(Ethylthio)-6,10-dimethyl-1,3,5,9-undecatetraene
CID 129804243
2,7-Di-tert-butylthiepin, 4-methyl-
CID 145031
1-(1-Tert-butylsulfanylethyl)-4-fluorobenzene-6-ide
CID 101857950
Butyl furfuryl sulfide
CID 528325

Frequently Asked Questions

What is the IUPAC name of 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene?
The IUPAC name of 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene (CID 123767942) is 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene.
What is the SMILES notation for 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene?
The canonical SMILES for 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene is C=CC=c1c(C=CC)c(C=CC)sc1=CC.
What is the InChIKey of 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene?
The InChIKey is VOWDHUTZKRJXHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18S/c1-5-9-12-13(10-6-2)15(11-7-3)16-14(12)8-4/h5-11H,1H2,2-4H3.
What are the key properties of 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene?
2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene has a molecular weight of 230.38 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylidene-4,5-bis(prop-1-enyl)-3-prop-2-enylidenethiophene is sourced from PubChem (CID 123767942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).