5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide

C11H11N3O2S — CID 54966607

IUPAC5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1OCc1cccs1
InChIInChI=1S/C11H11N3O2S/c12-7-4-9(10(13)15)11(14-5-7)16-6-8-2-1-3-17-8/h1-5H,6,12H2,(H2,13,15)
InChIKeyPQFKMBUXQJNJIA-UHFFFAOYSA-N
MW249.30 g/mol
LogP1.40
Rot. Bonds4

About 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide

5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide (PubChem CID 54966607) has the molecular formula C11H11N3O2S and a molecular weight of 249.30 g/mol. Its IUPAC name is 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide
PubChem CID54966607
Molecular FormulaC11H11N3O2S
Molecular Weight249.30 g/mol
Exact Mass249.06
IUPAC Name5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1OCc1cccs1
InChIInChI=1S/C11H11N3O2S/c12-7-4-9(10(13)15)11(14-5-7)16-6-8-2-1-3-17-8/h1-5H,6,12H2,(H2,13,15)
InChIKeyPQFKMBUXQJNJIA-UHFFFAOYSA-N
XLogP1.40
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide (CID 54966607) is 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide is NC(=O)c1cc(N)cnc1OCc1cccs1.
What is the InChIKey of 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide?
The InChIKey is PQFKMBUXQJNJIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S/c12-7-4-9(10(13)15)11(14-5-7)16-6-8-2-1-3-17-8/h1-5H,6,12H2,(H2,13,15).
What are the key properties of 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide?
5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide has a molecular weight of 249.30 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide is sourced from PubChem (CID 54966607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).