5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole

C15H10N2O2S — CID 140986058

IUPAC5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole
SMILESc1c[nH]c(-c2nc(-c3cccs3)c(-c3ccco3)o2)c1
InChIInChI=1S/C15H10N2O2S/c1-4-10(16-7-1)15-17-13(12-6-3-9-20-12)14(19-15)11-5-2-8-18-11/h1-9,16H
InChIKeyGQQPSITYCRCLDS-UHFFFAOYSA-N
MW282.32 g/mol
LogP4.66
Rot. Bonds3

About 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole

5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole (PubChem CID 140986058) has the molecular formula C15H10N2O2S and a molecular weight of 282.32 g/mol. Its IUPAC name is 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole.

Molecular Properties

Compound Name5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole
PubChem CID140986058
Molecular FormulaC15H10N2O2S
Molecular Weight282.32 g/mol
Exact Mass282.05
IUPAC Name5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole
SMILESc1c[nH]c(-c2nc(-c3cccs3)c(-c3ccco3)o2)c1
InChIInChI=1S/C15H10N2O2S/c1-4-10(16-7-1)15-17-13(12-6-3-9-20-12)14(19-15)11-5-2-8-18-11/h1-9,16H
InChIKeyGQQPSITYCRCLDS-UHFFFAOYSA-N
XLogP4.66
TPSA54.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(furan-2-yl)-N-((1-methyl-1H-pyrrol-2-yl)methyl)-N-(thiophen-2-ylmethyl)isoxazole-3-carboxamide
CID 49754175
2-[2-[2-[4-deuterio-2-(1,3-thiazol-4-yl)thiophen-3-yl]furan-3-yl]-1H-pyrrol-3-yl]-1,3-oxazole
CID 91496693
2-[3-(1H-pyrrol-2-yl)-4-thiophen-2-ylfuran-2-yl]-4-[4-(1,3-thiazol-2-yl)-1,2-oxazol-3-yl]-1,3-oxazole
CID 136622089
2-(furan-2-yl)-4-pyridin-2-yl-2-(1H-pyrrol-2-yl)-5-thiophen-2-yl-3H-1,3-oxazole
CID 140987563
2-(furan-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrrol-2-yl)-5-thiophen-2-yl-3H-1,2-oxazole
CID 141039475
[2-(furan-2-carbonyl)-1H-pyrrol-3-yl]-thiophen-2-ylmethanone
CID 141137269
4-(furan-2-yl)-2-pyridin-2-yl-2-(1H-pyrrol-2-yl)-5-thiophen-2-yl-3H-1,3-oxazole
CID 141178246
5-(Furan-2-yl)-3-(1,3-oxazol-2-yl)-4-thiophen-2-yl-1,2-oxazole
CID 141186209
5-(furan-2-yl)-4-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-oxazole
CID 141189938
2-[5-(2,3-dihydropyrrol-1-yl)-5-(furan-2-yl)-2-pyrrolidin-1-yl-2-thiophen-2-yl-1,3-dioxolan-4-yl]-1H-pyrrole
CID 141214113
2-(Furan-2-yl)-1,3-oxazole;1,3-oxazole;2-thiophen-2-ylfuran
CID 161151792
2-(Furan-2-yl)-1,3-oxazole;2-thiophen-2-ylfuran
CID 161472206

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole?
The IUPAC name of 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole (CID 140986058) is 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole.
What is the SMILES notation for 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole?
The canonical SMILES for 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole is c1c[nH]c(-c2nc(-c3cccs3)c(-c3ccco3)o2)c1.
What is the InChIKey of 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole?
The InChIKey is GQQPSITYCRCLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O2S/c1-4-10(16-7-1)15-17-13(12-6-3-9-20-12)14(19-15)11-5-2-8-18-11/h1-9,16H.
What are the key properties of 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole?
5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole has a molecular weight of 282.32 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-2-(1H-pyrrol-2-yl)-4-thiophen-2-yl-1,3-oxazole is sourced from PubChem (CID 140986058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).