N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide

C14H15BrN4O — CID 104642974

IUPACN-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide
SMILESCCc1cc(Br)ccc1NC(=O)c1ccc(NN)cn1
InChIInChI=1S/C14H15BrN4O/c1-2-9-7-10(15)3-5-12(9)18-14(20)13-6-4-11(19-16)8-17-13/h3-8,19H,2,16H2,1H3,(H,18,20)
InChIKeySDHRAZMVDDOSEW-UHFFFAOYSA-N
MW335.21 g/mol
LogP2.94
Rot. Bonds4

About N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide

N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide (PubChem CID 104642974) has the molecular formula C14H15BrN4O and a molecular weight of 335.21 g/mol. Its IUPAC name is N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide
PubChem CID104642974
Molecular FormulaC14H15BrN4O
Molecular Weight335.21 g/mol
Exact Mass334.04
IUPAC NameN-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide
SMILESCCc1cc(Br)ccc1NC(=O)c1ccc(NN)cn1
InChIInChI=1S/C14H15BrN4O/c1-2-9-7-10(15)3-5-12(9)18-14(20)13-6-4-11(19-16)8-17-13/h3-8,19H,2,16H2,1H3,(H,18,20)
InChIKeySDHRAZMVDDOSEW-UHFFFAOYSA-N
XLogP2.94
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.21
LogP ≤ 52.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-bromo-2-fluorophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642173
N-(4-bromo-2-ethylphenyl)-5-cyanopyridine-2-carboxamide
CID 81003561
N-(4-bromo-2-ethylphenyl)-2H-triazole-4-carboxamide
CID 81003417
N-(5-bromo-2-pyridinyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642521
N-(4-bromo-2,6-dichlorophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642535
N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642384
N-(2-bromo-3-methylphenyl)-5-hydrazinylpyridine-2-carboxamide
CID 113436381
N-(2-bromo-4-nitrophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 107810328
N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 103481467
N-[(3-bromophenyl)methyl]-5-hydrazinylpyridine-2-carboxamide
CID 113436329
N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 81287386
5-hydrazinyl-N-propylpyridine-2-carboxamide
CID 104642261

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide?
The IUPAC name of N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide (CID 104642974) is N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide.
What is the SMILES notation for N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide?
The canonical SMILES for N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide is CCc1cc(Br)ccc1NC(=O)c1ccc(NN)cn1.
What is the InChIKey of N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide?
The InChIKey is SDHRAZMVDDOSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN4O/c1-2-9-7-10(15)3-5-12(9)18-14(20)13-6-4-11(19-16)8-17-13/h3-8,19H,2,16H2,1H3,(H,18,20).
What are the key properties of N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide?
N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide has a molecular weight of 335.21 g/mol, XLogP of 2.94, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-ethylphenyl)-5-hydrazinylpyridine-2-carboxamide is sourced from PubChem (CID 104642974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).