3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine

C26H16N2S4 — CID 102393188

IUPAC3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
SMILESc1cncc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6cccnc6)s5)s4)s3)s2)c1
InChIInChI=1S/C26H16N2S4/c1-3-17(15-27-13-1)19-5-7-21(29-19)23-9-11-25(31-23)26-12-10-24(32-26)22-8-6-20(30-22)18-4-2-14-28-16-18/h1-16H
InChIKeyOVTROUKCPQBBER-UHFFFAOYSA-N
MW484.70 g/mol
LogP9.06
Rot. Bonds5

About 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine

3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine (PubChem CID 102393188) has the molecular formula C26H16N2S4 and a molecular weight of 484.70 g/mol. Its IUPAC name is 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine.

Molecular Properties

Compound Name3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
PubChem CID102393188
Molecular FormulaC26H16N2S4
Molecular Weight484.70 g/mol
Exact Mass484.02
IUPAC Name3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
SMILESc1cncc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6cccnc6)s5)s4)s3)s2)c1
InChIInChI=1S/C26H16N2S4/c1-3-17(15-27-13-1)19-5-7-21(29-19)23-9-11-25(31-23)26-12-10-24(32-26)22-8-6-20(30-22)18-4-2-14-28-16-18/h1-16H
InChIKeyOVTROUKCPQBBER-UHFFFAOYSA-N
XLogP9.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.70
LogP ≤ 59.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-pyridin-3-ylthiophene-2-thiol
CID 164530684
3-[4-(5-methylthiophen-2-yl)phenyl]pyridine
CID 130309277
3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine
CID 177401684
5-pyridin-3-ylthiophene-2-carboxamide
CID 142116945
3-(5-propylthiophen-2-yl)pyridine
CID 143245944
5-pyridin-3-ylthiophene-2-sulfinate
CID 70086435
4-cyclopropyl-3-(5-pyridin-3-ylthiophen-2-yl)pyridine
CID 70038300
(5-pyridin-3-ylthiophen-2-yl) formate
CID 174545765
cyclopenta[c]azepine
CID 638010
5-pyridin-3-yl-1,2-thiazole
CID 140618141
3-azulen-6-ylpyridine
CID 86232079
3-(5-hexylthiophen-2-yl)pyridine
CID 122397866

Frequently Asked Questions

What is the IUPAC name of 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
The IUPAC name of 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine (CID 102393188) is 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine.
What is the SMILES notation for 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
The canonical SMILES for 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine is c1cncc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6cccnc6)s5)s4)s3)s2)c1.
What is the InChIKey of 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
The InChIKey is OVTROUKCPQBBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16N2S4/c1-3-17(15-27-13-1)19-5-7-21(29-19)23-9-11-25(31-23)26-12-10-24(32-26)22-8-6-20(30-22)18-4-2-14-28-16-18/h1-16H.
What are the key properties of 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine?
3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine has a molecular weight of 484.70 g/mol, XLogP of 9.06, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine is sourced from PubChem (CID 102393188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).