(2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene

C12H15FS — CID 145140712

IUPAC(2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene
SMILESC=c1ccs/c1=C(F)/C(=C\C)CCC
InChIInChI=1S/C12H15FS/c1-4-6-10(5-2)11(13)12-9(3)7-8-14-12/h5,7-8H,3-4,6H2,1-2H3/b10-5-,12-11-
InChIKeyVOHIZXAAQKFIHD-UZQSCXJDSA-N
MW210.32 g/mol
LogP2.98
Rot. Bonds3

About (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene

(2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene (PubChem CID 145140712) has the molecular formula C12H15FS and a molecular weight of 210.32 g/mol. Its IUPAC name is (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene.

Molecular Properties

Compound Name(2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene
PubChem CID145140712
Molecular FormulaC12H15FS
Molecular Weight210.32 g/mol
Exact Mass210.09
IUPAC Name(2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene
SMILESC=c1ccs/c1=C(F)/C(=C\C)CCC
InChIInChI=1S/C12H15FS/c1-4-6-10(5-2)11(13)12-9(3)7-8-14-12/h5,7-8H,3-4,6H2,1-2H3/b10-5-,12-11-
InChIKeyVOHIZXAAQKFIHD-UZQSCXJDSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7,7a-Dihydrobenzothiophen
CID 21584106
Cyclohepta[c]thiophene
CID 129673588
1-Methylsulfanyl-4-(trifluoromethyl)cyclohexa-1,3-diene
CID 20080613
6-butyl-4-(trifluoromethyl)-2H-thiopyran
CID 22712813
7-Fluoro-7-methyl-2-(propan-2-ylsulfanylmethyl)cyclohepta-1,3,5-triene
CID 70967274
6-fluoro-8H-indeno[1,2-b]thiophene
CID 88526497
6-fluoro-3-methyl-5-methylidene-6H-1-benzothiophene
CID 89233565
(E)-3-fluoro-7-methyl-5-methylidene-8-prop-2-enylsulfanyloct-3-ene
CID 89247481
10-Fluoro-4,7-dimethyl-5lambda6-thiaspiro[4.5]deca-1(5),3,5(10),6,8-pentaene
CID 90896513
13-Fluoro-5-thiatricyclo[8.4.0.02,6]tetradeca-1,3,6,8,10,13-hexaene
CID 91527849
7,7-Difluoro-6-methylidene-5-methylsulfanylocta-1,4-diene
CID 123169330
6-(2-Methylbut-1-enylsulfanyl)-5-methylidene-3-(trifluoromethyl)hepta-1,3,6-triene
CID 123359278

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene?
The IUPAC name of (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene (CID 145140712) is (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene.
What is the SMILES notation for (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene?
The canonical SMILES for (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene is C=c1ccs/c1=C(F)/C(=C\C)CCC.
What is the InChIKey of (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene?
The InChIKey is VOHIZXAAQKFIHD-UZQSCXJDSA-N. The full InChI is InChI=1S/C12H15FS/c1-4-6-10(5-2)11(13)12-9(3)7-8-14-12/h5,7-8H,3-4,6H2,1-2H3/b10-5-,12-11-.
What are the key properties of (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene?
(2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene has a molecular weight of 210.32 g/mol, XLogP of 2.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(2Z)-2-ethylidene-1-fluoropentylidene]-3-methylidenethiophene is sourced from PubChem (CID 145140712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).