5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide

C15H12N2O2S — CID 68656727

IUPAC5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide
SMILESO=C(NCc1cccs1)c1ccc(-c2cccnc2)o1
InChIInChI=1S/C15H12N2O2S/c18-15(17-10-12-4-2-8-20-12)14-6-5-13(19-14)11-3-1-7-16-9-11/h1-9H,10H2,(H,17,18)
InChIKeyAHSYGZYPVWNKKQ-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.33
Rot. Bonds4

About 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide

5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide (PubChem CID 68656727) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide
PubChem CID68656727
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide
SMILESO=C(NCc1cccs1)c1ccc(-c2cccnc2)o1
InChIInChI=1S/C15H12N2O2S/c18-15(17-10-12-4-2-8-20-12)14-6-5-13(19-14)11-3-1-7-16-9-11/h1-9H,10H2,(H,17,18)
InChIKeyAHSYGZYPVWNKKQ-UHFFFAOYSA-N
XLogP3.33
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The IUPAC name of 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide (CID 68656727) is 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The canonical SMILES for 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide is O=C(NCc1cccs1)c1ccc(-c2cccnc2)o1.
What is the InChIKey of 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The InChIKey is AHSYGZYPVWNKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c18-15(17-10-12-4-2-8-20-12)14-6-5-13(19-14)11-3-1-7-16-9-11/h1-9H,10H2,(H,17,18).
What are the key properties of 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide has a molecular weight of 284.34 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-yl-N-(thiophen-2-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 68656727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).