5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide

C8H10BrN3O — CID 62170805

IUPAC5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide
SMILESCNC(=O)c1cc(Br)cnc1NC
InChIInChI=1S/C8H10BrN3O/c1-10-7-6(8(13)11-2)3-5(9)4-12-7/h3-4H,1-2H3,(H,10,12)(H,11,13)
InChIKeyRLZQCFCVHMATDW-UHFFFAOYSA-N
MW244.09 g/mol
LogP1.25
Rot. Bonds2

About 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide

5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide (PubChem CID 62170805) has the molecular formula C8H10BrN3O and a molecular weight of 244.09 g/mol. Its IUPAC name is 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide
PubChem CID62170805
Molecular FormulaC8H10BrN3O
Molecular Weight244.09 g/mol
Exact Mass243.00
IUPAC Name5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide
SMILESCNC(=O)c1cc(Br)cnc1NC
InChIInChI=1S/C8H10BrN3O/c1-10-7-6(8(13)11-2)3-5(9)4-12-7/h3-4H,1-2H3,(H,10,12)(H,11,13)
InChIKeyRLZQCFCVHMATDW-UHFFFAOYSA-N
XLogP1.25
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.09
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide (CID 62170805) is 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide is CNC(=O)c1cc(Br)cnc1NC.
What is the InChIKey of 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide?
The InChIKey is RLZQCFCVHMATDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrN3O/c1-10-7-6(8(13)11-2)3-5(9)4-12-7/h3-4H,1-2H3,(H,10,12)(H,11,13).
What are the key properties of 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide?
5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide has a molecular weight of 244.09 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62170805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).