N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide

C12H12BrN5O — CID 81256857

IUPACN-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)Nc2ccc(Br)cn2)cn1
InChIInChI=1S/C12H12BrN5O/c1-7-4-10(18-14)9(6-15-7)12(19)17-11-3-2-8(13)5-16-11/h2-6H,14H2,1H3,(H,15,18)(H,16,17,19)
InChIKeyPKRLNALEZHKDOU-UHFFFAOYSA-N
MW322.17 g/mol
LogP2.09
Rot. Bonds3

About N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide

N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide (PubChem CID 81256857) has the molecular formula C12H12BrN5O and a molecular weight of 322.17 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
PubChem CID81256857
Molecular FormulaC12H12BrN5O
Molecular Weight322.17 g/mol
Exact Mass321.02
IUPAC NameN-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)Nc2ccc(Br)cn2)cn1
InChIInChI=1S/C12H12BrN5O/c1-7-4-10(18-14)9(6-15-7)12(19)17-11-3-2-8(13)5-16-11/h2-6H,14H2,1H3,(H,15,18)(H,16,17,19)
InChIKeyPKRLNALEZHKDOU-UHFFFAOYSA-N
XLogP2.09
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.17
LogP ≤ 52.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-bromo-2-pyridinyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81236115
4-hydrazinyl-6-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 81256191
N-(5-bromo-2-methoxyphenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81245507
N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 107603475
N-(5-bromo-2-pyridinyl)-4-hydrazinyl-3-methylbenzamide
CID 63212020
N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81272267
4-hydrazinyl-6-methyl-N-pyrimidin-5-ylpyridine-3-carboxamide
CID 107590009
N-(3,5-dichlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256534
N-(4-ethylphenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256559
4-hydrazinyl-6-methylpyridine-3-carboxylic acid
CID 82863432
N-(5-bromo-2-pyridinyl)-3,5-dimethylbenzamide
CID 953685
4-hydrazinyl-6-methyl-N-(1,2,4-triazin-3-yl)pyridine-3-carboxamide
CID 114389592

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide (CID 81256857) is N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide is Cc1cc(NN)c(C(=O)Nc2ccc(Br)cn2)cn1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The InChIKey is PKRLNALEZHKDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrN5O/c1-7-4-10(18-14)9(6-15-7)12(19)17-11-3-2-8(13)5-16-11/h2-6H,14H2,1H3,(H,15,18)(H,16,17,19).
What are the key properties of N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide has a molecular weight of 322.17 g/mol, XLogP of 2.09, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81256857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).