N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide

C12H11BrClN5O — CID 83170176

IUPACN-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
SMILESCc1cc(Br)cnc1NC(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C12H11BrClN5O/c1-6-2-8(13)5-16-11(6)18-12(20)7-3-9(14)17-10(4-7)19-15/h2-5H,15H2,1H3,(H,17,19)(H,16,18,20)
InChIKeyHDIHJHQQAZMSKY-UHFFFAOYSA-N
MW356.61 g/mol
LogP2.74
Rot. Bonds3

About N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide

N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide (PubChem CID 83170176) has the molecular formula C12H11BrClN5O and a molecular weight of 356.61 g/mol. Its IUPAC name is N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
PubChem CID83170176
Molecular FormulaC12H11BrClN5O
Molecular Weight356.61 g/mol
Exact Mass354.98
IUPAC NameN-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
SMILESCc1cc(Br)cnc1NC(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C12H11BrClN5O/c1-6-2-8(13)5-16-11(6)18-12(20)7-3-9(14)17-10(4-7)19-15/h2-5H,15H2,1H3,(H,17,19)(H,16,18,20)
InChIKeyHDIHJHQQAZMSKY-UHFFFAOYSA-N
XLogP2.74
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.61
LogP ≤ 52.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydrazinylpyridine-3-carboxamide
CID 83170019
N-(5-bromo-3-methyl-2-pyridinyl)-4-hydrazinyl-3-methylbenzamide
CID 83171125
2-chloro-6-hydrazinyl-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 62248114
2-chloro-N-(2,3-dimethylphenyl)-6-hydrazinylpyridine-4-carboxamide
CID 62241615
2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide
CID 62241867
N-(5-bromo-3-methyl-2-pyridinyl)-5-chlorofuran-2-carboxamide
CID 81489265
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-4-methylbenzamide
CID 106509648
2-chloro-6-hydrazinyl-N-(1-methylpyrazol-4-yl)pyridine-4-carboxamide
CID 62242493
N-(4-bromo-2,5-difluorophenyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 107616840
2-(aminomethyl)-N-(5-bromo-3-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 83167261
N-(5-bromo-2-cyanophenyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 107801433
N-(5-bromo-3-methyl-2-pyridinyl)-4-chloropyridine-3-carboxamide
CID 83166694

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide (CID 83170176) is N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide is Cc1cc(Br)cnc1NC(=O)c1cc(Cl)nc(NN)c1.
What is the InChIKey of N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide?
The InChIKey is HDIHJHQQAZMSKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrClN5O/c1-6-2-8(13)5-16-11(6)18-12(20)7-3-9(14)17-10(4-7)19-15/h2-5H,15H2,1H3,(H,17,19)(H,16,18,20).
What are the key properties of N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide?
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide has a molecular weight of 356.61 g/mol, XLogP of 2.74, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 83170176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).