3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide

C12H14ClN5O2 — CID 106422909

About 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide

3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide (PubChem CID 106422909) has the molecular formula C12H14ClN5O2 and a molecular weight of 295.73 g/mol. Its IUPAC name is 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
• PubChem CID: 106422909
• Molecular Formula: C12H14ClN5O2
• Molecular Weight: 295.73 g/mol
• Exact Mass: 295.08
• IUPAC Name: 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide
• SMILES: CNc1ccc(Cl)c(C(=O)NCCc2nc(C)no2)n1
• InChI: InChI=1S/C12H14ClN5O2/c1-7-16-10(20-18-7)5-6-15-12(19)11-8(13)3-4-9(14-2)17-11/h3-4H,5-6H2,1-2H3,(H,14,17)(H,15,19)
• InChIKey: RBVMVJWTSLGSEM-UHFFFAOYSA-N
• XLogP: 1.44
• TPSA: 92.94 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	295.73
LogP ≤ 5	1.44
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?

The IUPAC name of 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide (CID 106422909) is 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide.

What is the SMILES notation for 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?

The canonical SMILES for 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide is CNc1ccc(Cl)c(C(=O)NCCc2nc(C)no2)n1.

What is the InChIKey of 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?

The InChIKey is RBVMVJWTSLGSEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN5O2/c1-7-16-10(20-18-7)5-6-15-12(19)11-8(13)3-4-9(14-2)17-11/h3-4H,5-6H2,1-2H3,(H,14,17)(H,15,19).

What are the key properties of 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide?

3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 295.73 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-6-(methylamino)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 106422909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).