2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide

C19H15N3O2S — CID 2644456

IUPAC2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCc1ccc2c(CC(=O)Nc3nc(-c4ccccn4)cs3)coc2c1
InChIInChI=1S/C19H15N3O2S/c1-12-5-6-14-13(10-24-17(14)8-12)9-18(23)22-19-21-16(11-25-19)15-4-2-3-7-20-15/h2-8,10-11H,9H2,1H3,(H,21,22,23)
InChIKeyCUGWIWKVPBODHB-UHFFFAOYSA-N
MW349.42 g/mol
LogP4.44
Rot. Bonds4

About 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide

2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 2644456) has the molecular formula C19H15N3O2S and a molecular weight of 349.42 g/mol. Its IUPAC name is 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID2644456
Molecular FormulaC19H15N3O2S
Molecular Weight349.42 g/mol
Exact Mass349.09
IUPAC Name2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCc1ccc2c(CC(=O)Nc3nc(-c4ccccn4)cs3)coc2c1
InChIInChI=1S/C19H15N3O2S/c1-12-5-6-14-13(10-24-17(14)8-12)9-18(23)22-19-21-16(11-25-19)15-4-2-3-7-20-15/h2-8,10-11H,9H2,1H3,(H,21,22,23)
InChIKeyCUGWIWKVPBODHB-UHFFFAOYSA-N
XLogP4.44
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide (CID 2644456) is 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide is Cc1ccc2c(CC(=O)Nc3nc(-c4ccccn4)cs3)coc2c1.
What is the InChIKey of 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is CUGWIWKVPBODHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2S/c1-12-5-6-14-13(10-24-17(14)8-12)9-18(23)22-19-21-16(11-25-19)15-4-2-3-7-20-15/h2-8,10-11H,9H2,1H3,(H,21,22,23).
What are the key properties of 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 349.42 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-1-benzofuran-3-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 2644456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).