6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile

C14H7N5OS — CID 82219401

IUPAC6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
SMILESN#Cc1c(-c2ccco2)nc2sc(-c3cccnc3)nn12
InChIInChI=1S/C14H7N5OS/c15-7-10-12(11-4-2-6-20-11)17-14-19(10)18-13(21-14)9-3-1-5-16-8-9/h1-6,8H
InChIKeyPKTHOIKKYQZGDG-UHFFFAOYSA-N
MW293.31 g/mol
LogP2.98
Rot. Bonds2

About 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile

6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile (PubChem CID 82219401) has the molecular formula C14H7N5OS and a molecular weight of 293.31 g/mol. Its IUPAC name is 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile.

Molecular Properties

Compound Name6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
PubChem CID82219401
Molecular FormulaC14H7N5OS
Molecular Weight293.31 g/mol
Exact Mass293.04
IUPAC Name6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
SMILESN#Cc1c(-c2ccco2)nc2sc(-c3cccnc3)nn12
InChIInChI=1S/C14H7N5OS/c15-7-10-12(11-4-2-6-20-11)17-14-19(10)18-13(21-14)9-3-1-5-16-8-9/h1-6,8H
InChIKeyPKTHOIKKYQZGDG-UHFFFAOYSA-N
XLogP2.98
TPSA80.01 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.31
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

2-(furan-2-yl)-6-pyridin-2-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
CID 82219440
2-phenyl-6-pyridin-4-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
CID 82219377
2-(methoxymethyl)-6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
CID 82219364
6-tert-butyl-2-(3-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
CID 94961266
2-(4-methylphenyl)-6-thiophen-2-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
CID 94961253
2-amino-4-(furan-2-yl)-5-propyl-6-pyridin-3-ylpyridine-3-carbonitrile
CID 56861364
2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062379
2-propan-2-yl-6-pyridin-4-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
CID 82219370
2-(4-chlorophenyl)-6-methylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile
CID 82219272
2-(furan-2-yl)-5-pyridin-3-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 2823019
[2-(3-methylphenyl)-6-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazol-5-yl]methanol
CID 94961602
2-(cyanomethylsulfanyl)-4-(furan-2-yl)-6-pyridin-3-ylpyridine-3-carbonitrile
CID 139219253

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile?
The IUPAC name of 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile (CID 82219401) is 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile.
What is the SMILES notation for 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile?
The canonical SMILES for 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile is N#Cc1c(-c2ccco2)nc2sc(-c3cccnc3)nn12.
What is the InChIKey of 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile?
The InChIKey is PKTHOIKKYQZGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7N5OS/c15-7-10-12(11-4-2-6-20-11)17-14-19(10)18-13(21-14)9-3-1-5-16-8-9/h1-6,8H.
What are the key properties of 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile?
6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile has a molecular weight of 293.31 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-2-pyridin-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbonitrile is sourced from PubChem (CID 82219401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).