2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole

C13H10N2O2S — CID 119052742

IUPAC2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole
SMILESCOc1ncccc1-c1csc(-c2ccoc2)n1
InChIInChI=1S/C13H10N2O2S/c1-16-12-10(3-2-5-14-12)11-8-18-13(15-11)9-4-6-17-7-9/h2-8H,1H3
InChIKeyUNPBDVVLZIGRKL-UHFFFAOYSA-N
MW258.30 g/mol
LogP3.47
Rot. Bonds3

About 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole

2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole (PubChem CID 119052742) has the molecular formula C13H10N2O2S and a molecular weight of 258.30 g/mol. Its IUPAC name is 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole
PubChem CID119052742
Molecular FormulaC13H10N2O2S
Molecular Weight258.30 g/mol
Exact Mass258.05
IUPAC Name2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole
SMILESCOc1ncccc1-c1csc(-c2ccoc2)n1
InChIInChI=1S/C13H10N2O2S/c1-16-12-10(3-2-5-14-12)11-8-18-13(15-11)9-4-6-17-7-9/h2-8H,1H3
InChIKeyUNPBDVVLZIGRKL-UHFFFAOYSA-N
XLogP3.47
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole?
The IUPAC name of 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole (CID 119052742) is 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole?
The canonical SMILES for 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole is COc1ncccc1-c1csc(-c2ccoc2)n1.
What is the InChIKey of 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole?
The InChIKey is UNPBDVVLZIGRKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O2S/c1-16-12-10(3-2-5-14-12)11-8-18-13(15-11)9-4-6-17-7-9/h2-8H,1H3.
What are the key properties of 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole?
2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole has a molecular weight of 258.30 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-4-(2-methoxy-3-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 119052742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).