2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine

C22H16N2O2S — CID 141066194

IUPAC2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine
SMILESC1=C(c2ccccn2)C(c2ccc[nH]2)=C(c2ccco2)C(c2cccs2)O1
InChIInChI=1S/C22H16N2O2S/c1-2-10-23-16(6-1)15-14-26-22(19-9-5-13-27-19)21(18-8-4-12-25-18)20(15)17-7-3-11-24-17/h1-14,22,24H
InChIKeyVVNUNZUXZRIPFT-UHFFFAOYSA-N
MW372.45 g/mol
LogP5.79
Rot. Bonds4

About 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine

2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine (PubChem CID 141066194) has the molecular formula C22H16N2O2S and a molecular weight of 372.45 g/mol. Its IUPAC name is 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine.

Molecular Properties

Compound Name2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine
PubChem CID141066194
Molecular FormulaC22H16N2O2S
Molecular Weight372.45 g/mol
Exact Mass372.09
IUPAC Name2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine
SMILESC1=C(c2ccccn2)C(c2ccc[nH]2)=C(c2ccco2)C(c2cccs2)O1
InChIInChI=1S/C22H16N2O2S/c1-2-10-23-16(6-1)15-14-26-22(19-9-5-13-27-19)21(18-8-4-12-25-18)20(15)17-7-3-11-24-17/h1-14,22,24H
InChIKeyVVNUNZUXZRIPFT-UHFFFAOYSA-N
XLogP5.79
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.45
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(Furan-3-yl)-2-pyridin-4-yl-6-thiophen-2-ylpyridine
CID 44423810
4-(Furan-3-yl)-2-pyridin-4-yl-6-thiophen-3-ylpyridine
CID 44423829
4-(Furan-2-yl)-2-pyridin-4-yl-6-thiophen-3-ylpyridine
CID 44423834
4-(Furan-2-yl)-2-pyridin-3-yl-6-thiophen-2-ylpyridine
CID 44423836
4-Furan-2-yl-2-thiophen-2-yl-pyridine
CID 44276312
2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-1-(1H-pyrrol-2-yl)ethanone
CID 2459051
Furyl(thienyl)pyrrole
CID 129782024
difluoro-[4-(furan-2-yl)-3,5,6-trimethoxy-1,6-dimethyl-2-(1H-pyrrol-2-yl)cyclohexa-2,4-dien-1-yl]-methyl-dipyridin-2-yl-lambda6-sulfane
CID 141072727
2-(furan-2-yl)-3-thiophen-2-yl-1H-pyrrole
CID 18788916
methyl 5-[6-(furan-2-yl)-3-methylsulfonyl-3-(1H-pyrrol-2-yl)hexyl]thiophene-2-carboxylate
CID 57255187
2-[5-(Furan-2-yl)thiophen-2-yl]pyridine
CID 60131532
2-[5-(Furan-3-yl)thiophen-2-yl]pyridine
CID 60131539

Frequently Asked Questions

What is the IUPAC name of 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine?
The IUPAC name of 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine (CID 141066194) is 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine.
What is the SMILES notation for 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine?
The canonical SMILES for 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine is C1=C(c2ccccn2)C(c2ccc[nH]2)=C(c2ccco2)C(c2cccs2)O1.
What is the InChIKey of 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine?
The InChIKey is VVNUNZUXZRIPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O2S/c1-2-10-23-16(6-1)15-14-26-22(19-9-5-13-27-19)21(18-8-4-12-25-18)20(15)17-7-3-11-24-17/h1-14,22,24H.
What are the key properties of 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine?
2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine has a molecular weight of 372.45 g/mol, XLogP of 5.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-2H-pyran-5-yl]pyridine is sourced from PubChem (CID 141066194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).