(2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene

C10H12S — CID 142103413

IUPAC(2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene
SMILESC=c1cc(C)s/c1=C/C=C\C
InChIInChI=1S/C10H12S/c1-4-5-6-10-8(2)7-9(3)11-10/h4-7H,2H2,1,3H3/b5-4-,10-6+
InChIKeyFSFHEBMDDUMLBV-VWJYOPCBSA-N
MW164.27 g/mol
LogP1.82
Rot. Bonds1

About (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene

(2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene (PubChem CID 142103413) has the molecular formula C10H12S and a molecular weight of 164.27 g/mol. Its IUPAC name is (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene.

Molecular Properties

Compound Name(2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene
PubChem CID142103413
Molecular FormulaC10H12S
Molecular Weight164.27 g/mol
Exact Mass164.07
IUPAC Name(2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene
SMILESC=c1cc(C)s/c1=C/C=C\C
InChIInChI=1S/C10H12S/c1-4-5-6-10-8(2)7-9(3)11-10/h4-7H,2H2,1,3H3/b5-4-,10-6+
InChIKeyFSFHEBMDDUMLBV-VWJYOPCBSA-N
XLogP1.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.27
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene 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

2,7-Di-tert-butylthiepin
CID 145017
5-[2,3-Bis(tert-butylsulfanyl)cycloprop-2-en-1-ylidene]cyclopenta-1,3-diene
CID 13020089
Methylcyclopenta[b]thiophene
CID 21095561
Thiaazulene
CID 22111386
4-Ethylthiocyclopentadiene
CID 68403138
2-Ethylidene-3-methylidene-5-(2,2,2-trifluoroethyl)thiophene
CID 123823833
(2E)-2-[(4Z)-6-fluoro-2,3-dimethylidenehepta-4,6-dienylidene]-3-methylidene-5-propylthiophene
CID 145203819
(3Z)-3-[(2E)-2-fluoro-3-methylpenta-2,4-dienylidene]-5-methylthiophene
CID 163415117
Ethylfurfuryl sulfide
CID 528326
Lithium ethylsulfanylmethylbenzene
CID 14939640
2,7-Diisopropylthiepin
CID 129654671
2,4-Dimethyl-3-methylsulfanylpenta-1,3-diene
CID 134975252

Frequently Asked Questions

What is the IUPAC name of (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene?
The IUPAC name of (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene (CID 142103413) is (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene.
What is the SMILES notation for (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene?
The canonical SMILES for (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene is C=c1cc(C)s/c1=C/C=C\C.
What is the InChIKey of (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene?
The InChIKey is FSFHEBMDDUMLBV-VWJYOPCBSA-N. The full InChI is InChI=1S/C10H12S/c1-4-5-6-10-8(2)7-9(3)11-10/h4-7H,2H2,1,3H3/b5-4-,10-6+.
What are the key properties of (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene?
(2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene has a molecular weight of 164.27 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(Z)-but-2-enylidene]-5-methyl-3-methylidenethiophene is sourced from PubChem (CID 142103413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).