N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide

C12H11BrN4O — CID 62238936

IUPACN-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)Nc2ccc(Br)cn2)n1
InChIInChI=1S/C12H11BrN4O/c1-14-10-4-2-3-9(16-10)12(18)17-11-6-5-8(13)7-15-11/h2-7H,1H3,(H,14,16)(H,15,17,18)
InChIKeyGXMNYBOJGUBTMS-UHFFFAOYSA-N
MW307.15 g/mol
LogP2.53
Rot. Bonds3

About N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide

N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide (PubChem CID 62238936) has the molecular formula C12H11BrN4O and a molecular weight of 307.15 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
PubChem CID62238936
Molecular FormulaC12H11BrN4O
Molecular Weight307.15 g/mol
Exact Mass306.01
IUPAC NameN-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)Nc2ccc(Br)cn2)n1
InChIInChI=1S/C12H11BrN4O/c1-14-10-4-2-3-9(16-10)12(18)17-11-6-5-8(13)7-15-11/h2-7H,1H3,(H,14,16)(H,15,17,18)
InChIKeyGXMNYBOJGUBTMS-UHFFFAOYSA-N
XLogP2.53
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.15
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-4-methyl-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
CID 79730155
N-(5-bromo-6-methyl-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
CID 79048918
N-(5-bromo-1,3-thiazol-2-yl)-6-(methylamino)pyridine-2-carboxamide
CID 55052576
N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 81287386
N-(3-bromo-2-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 107630995
N-(5-bromo-2-cyanophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 107801255
N-(5-acetyl-2-pyridinyl)-5-bromopyridine-2-carboxamide
CID 75514307
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62238561
N-(4-bromo-3-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62239926
2-(1-aminoethyl)-N-(5-bromo-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 66374394
N-(5-bromo-2-pyridinyl)-2,6-dichloropyridine-4-carboxamide
CID 43132088

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide (CID 62238936) is N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide is CNc1cccc(C(=O)Nc2ccc(Br)cn2)n1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is GXMNYBOJGUBTMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN4O/c1-14-10-4-2-3-9(16-10)12(18)17-11-6-5-8(13)7-15-11/h2-7H,1H3,(H,14,16)(H,15,17,18).
What are the key properties of N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide?
N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 307.15 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62238936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).