6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide

C10H8ClN3OS — CID 66355896

IUPAC6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide
SMILESNc1ccc(Cl)c(C(=O)Nc2ccsc2)n1
InChIInChI=1S/C10H8ClN3OS/c11-7-1-2-8(12)14-9(7)10(15)13-6-3-4-16-5-6/h1-5H,(H2,12,14)(H,13,15)
InChIKeyCTZYLOLEDOFTLI-UHFFFAOYSA-N
MW253.71 g/mol
LogP2.63
Rot. Bonds2

About 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide

6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide (PubChem CID 66355896) has the molecular formula C10H8ClN3OS and a molecular weight of 253.71 g/mol. Its IUPAC name is 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide
PubChem CID66355896
Molecular FormulaC10H8ClN3OS
Molecular Weight253.71 g/mol
Exact Mass253.01
IUPAC Name6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide
SMILESNc1ccc(Cl)c(C(=O)Nc2ccsc2)n1
InChIInChI=1S/C10H8ClN3OS/c11-7-1-2-8(12)14-9(7)10(15)13-6-3-4-16-5-6/h1-5H,(H2,12,14)(H,13,15)
InChIKeyCTZYLOLEDOFTLI-UHFFFAOYSA-N
XLogP2.63
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.71
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide (CID 66355896) is 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide is Nc1ccc(Cl)c(C(=O)Nc2ccsc2)n1.
What is the InChIKey of 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide?
The InChIKey is CTZYLOLEDOFTLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3OS/c11-7-1-2-8(12)14-9(7)10(15)13-6-3-4-16-5-6/h1-5H,(H2,12,14)(H,13,15).
What are the key properties of 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide?
6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide has a molecular weight of 253.71 g/mol, XLogP of 2.63, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-thiophen-3-ylpyridine-2-carboxamide is sourced from PubChem (CID 66355896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).