2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide

C19H14N2O2S — CID 11724443

IUPAC2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide
SMILESO=C(Cc1cccc2occc12)Nc1csc(-c2ccncc2)c1
InChIInChI=1S/C19H14N2O2S/c22-19(10-14-2-1-3-17-16(14)6-9-23-17)21-15-11-18(24-12-15)13-4-7-20-8-5-13/h1-9,11-12H,10H2,(H,21,22)
InChIKeyMWAJHWDZYVIINQ-UHFFFAOYSA-N
MW334.40 g/mol
LogP4.74
Rot. Bonds4

About 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide

2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide (PubChem CID 11724443) has the molecular formula C19H14N2O2S and a molecular weight of 334.40 g/mol. Its IUPAC name is 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide.

Molecular Properties

Compound Name2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide
PubChem CID11724443
Molecular FormulaC19H14N2O2S
Molecular Weight334.40 g/mol
Exact Mass334.08
IUPAC Name2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide
SMILESO=C(Cc1cccc2occc12)Nc1csc(-c2ccncc2)c1
InChIInChI=1S/C19H14N2O2S/c22-19(10-14-2-1-3-17-16(14)6-9-23-17)21-15-11-18(24-12-15)13-4-7-20-8-5-13/h1-9,11-12H,10H2,(H,21,22)
InChIKeyMWAJHWDZYVIINQ-UHFFFAOYSA-N
XLogP4.74
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide?
The IUPAC name of 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide (CID 11724443) is 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide.
What is the SMILES notation for 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide?
The canonical SMILES for 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide is O=C(Cc1cccc2occc12)Nc1csc(-c2ccncc2)c1.
What is the InChIKey of 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide?
The InChIKey is MWAJHWDZYVIINQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2S/c22-19(10-14-2-1-3-17-16(14)6-9-23-17)21-15-11-18(24-12-15)13-4-7-20-8-5-13/h1-9,11-12H,10H2,(H,21,22).
What are the key properties of 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide?
2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide has a molecular weight of 334.40 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-4-yl)-N-(5-pyridin-4-ylthiophen-3-yl)acetamide is sourced from PubChem (CID 11724443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).