9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole

C22H17NS2 — CID 59403674

IUPAC9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3ccc(-c4cccs4)s3)ccc21
InChIInChI=1S/C22H17NS2/c1-2-23-18-7-4-3-6-16(18)17-14-15(9-10-19(17)23)20-11-12-22(25-20)21-8-5-13-24-21/h3-14H,2H2,1H3
InChIKeyVTFCCWCNDUPNJI-UHFFFAOYSA-N
MW359.52 g/mol
LogP7.27
Rot. Bonds3

About 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole

9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole (PubChem CID 59403674) has the molecular formula C22H17NS2 and a molecular weight of 359.52 g/mol. Its IUPAC name is 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole.

Molecular Properties

Compound Name9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole
PubChem CID59403674
Molecular FormulaC22H17NS2
Molecular Weight359.52 g/mol
Exact Mass359.08
IUPAC Name9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3ccc(-c4cccs4)s3)ccc21
InChIInChI=1S/C22H17NS2/c1-2-23-18-7-4-3-6-16(18)17-14-15(9-10-19(17)23)20-11-12-22(25-20)21-8-5-13-24-21/h3-14H,2H2,1H3
InChIKeyVTFCCWCNDUPNJI-UHFFFAOYSA-N
XLogP7.27
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.52
LogP ≤ 57.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-octyl-3-[5-[5-[5-(9-octylcarbazol-3-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]carbazole
CID 134391330
9-ethyl-3-[4-hexyl-5-[5-[5-(3-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]carbazole
CID 59403655
9-ethyl-3-[5-[4-[2-[4-[5-(9-ethylcarbazol-3-yl)thiophen-2-yl]phenyl]pyrido[2,3-b]pyrazin-3-yl]phenyl]thiophen-2-yl]carbazole
CID 101215396
9-ethyl-3-[8-[3-[8-(9-ethylcarbazol-3-yl)dibenzothiophen-2-yl]phenyl]dibenzothiophen-2-yl]carbazole
CID 58038560
9-ethyl-3-(4-thiophen-2-yl-1,2-dihydrotriazol-3-yl)carbazole
CID 145393053
9-ethyl-3-[(E)-2-thiophen-2-ylethenyl]carbazole
CID 139207175
9-ethyl-2-[7-(9-ethylcarbazol-2-yl)triphenylen-2-yl]carbazole
CID 141303114
4-[5-(9-heptadecan-9-ylcarbazol-3-yl)thiophen-2-yl]-7-thiophen-2-yl-2,1,3-benzothiadiazole
CID 102583438
2-[2,6-bis(5-thiophen-2-ylthiophen-2-yl)-10-(2-triethylsilylethynyl)anthracen-9-yl]ethynyl-triethylsilane
CID 102581509
2,3,5,6-tetrakis(9-ethylcarbazol-3-yl)benzene-1,4-dicarbonitrile
CID 118404976
2-thiophen-2-yl-5-[6-(5-thiophen-2-ylthiophen-2-yl)anthracen-2-yl]thiophene
CID 23596942
2-cyano-3-[5-[5-[5-[5-[9-ethyl-3-[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]sulfanylcarbazol-2-yl]sulfanylthiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]propanoic acid
CID 132821185

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole?
The IUPAC name of 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole (CID 59403674) is 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole.
What is the SMILES notation for 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole?
The canonical SMILES for 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole is CCn1c2ccccc2c2cc(-c3ccc(-c4cccs4)s3)ccc21.
What is the InChIKey of 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole?
The InChIKey is VTFCCWCNDUPNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NS2/c1-2-23-18-7-4-3-6-16(18)17-14-15(9-10-19(17)23)20-11-12-22(25-20)21-8-5-13-24-21/h3-14H,2H2,1H3.
What are the key properties of 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole?
9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole has a molecular weight of 359.52 g/mol, XLogP of 7.27, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole is sourced from PubChem (CID 59403674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).