ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene

C12H16S2 — CID 91463281

IUPACethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
SMILESCC.Cc1ccc(-c2ccc(C)s2)s1
InChIInChI=1S/C10H10S2.C2H6/c1-7-3-5-9(11-7)10-6-4-8(2)12-10;1-2/h3-6H,1-2H3;1-2H3
InChIKeyUFAGSSDWNWJLDO-UHFFFAOYSA-N
MW224.39 g/mol
LogP5.12
Rot. Bonds1

About ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene

ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene (PubChem CID 91463281) has the molecular formula C12H16S2 and a molecular weight of 224.39 g/mol. Its IUPAC name is ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene.

Molecular Properties

Compound Nameethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
PubChem CID91463281
Molecular FormulaC12H16S2
Molecular Weight224.39 g/mol
Exact Mass224.07
IUPAC Nameethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
SMILESCC.Cc1ccc(-c2ccc(C)s2)s1
InChIInChI=1S/C10H10S2.C2H6/c1-7-3-5-9(11-7)10-6-4-8(2)12-10;1-2/h3-6H,1-2H3;1-2H3
InChIKeyUFAGSSDWNWJLDO-UHFFFAOYSA-N
XLogP5.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.39
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-bis(5-methylthiophen-2-yl)thieno[3,2-b]thiophene;ethane
CID 161142248
2,5-bis(5-methylthiophen-2-yl)thieno[3,2-b]thiophene
CID 71014682
2,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]pyrazine
CID 22960139
4-[5-(5-methylthiophen-2-yl)thiophen-2-yl]pyridine
CID 23386720
2-methyl-5-[5-[4-[5-(5-methylthiophen-2-yl)thiophen-2-yl]naphthalen-1-yl]thiophen-2-yl]thiophene
CID 102203513
[5-[5-(5-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]methanol
CID 54194493
7,16-bis(5-methylthiophen-2-yl)-6,17-dithiapentacyclo[11.7.0.02,10.05,9.014,18]icosa-1(13),2(10),3,5(9),7,11,14(18),15,19-nonaene
CID 144714716
2-(1-iodoethyl)-5-(5-methylthiophen-2-yl)thiophene
CID 129178875
ethane;[2-(5-methylthiophen-2-yl)phenyl]methanamine
CID 156737353
2-methyl-5-[5-[5-[(E)-prop-1-enyl]thiophen-2-yl]thiophen-2-yl]thiophene
CID 166512368
2-methyl-5-thiophen-2-ylthiophene;propane
CID 142257628
5-[5-(5-methylthiophen-2-yl)thiophen-2-yl]thiophene-2-carboxylic acid
CID 135215247

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene?
The IUPAC name of ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene (CID 91463281) is ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene.
What is the SMILES notation for ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene?
The canonical SMILES for ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene is CC.Cc1ccc(-c2ccc(C)s2)s1.
What is the InChIKey of ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene?
The InChIKey is UFAGSSDWNWJLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10S2.C2H6/c1-7-3-5-9(11-7)10-6-4-8(2)12-10;1-2/h3-6H,1-2H3;1-2H3.
What are the key properties of ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene?
ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene has a molecular weight of 224.39 g/mol, XLogP of 5.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene is sourced from PubChem (CID 91463281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).