5-chloro-6-oxo-1H-pyridine-3-carbohydrazide

C6H6ClN3O2 — CID 130843008

IUPAC5-chloro-6-oxo-1H-pyridine-3-carbohydrazide
SMILESNNC(=O)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C6H6ClN3O2/c7-4-1-3(5(11)10-8)2-9-6(4)12/h1-2H,8H2,(H,9,12)(H,10,11)
InChIKeyQXAMTRGDJMWNPP-UHFFFAOYSA-N
MW187.59 g/mol
LogP-0.37
Rot. Bonds1

About 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide

5-chloro-6-oxo-1H-pyridine-3-carbohydrazide (PubChem CID 130843008) has the molecular formula C6H6ClN3O2 and a molecular weight of 187.59 g/mol. Its IUPAC name is 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide.

Molecular Properties

Compound Name5-chloro-6-oxo-1H-pyridine-3-carbohydrazide
PubChem CID130843008
Molecular FormulaC6H6ClN3O2
Molecular Weight187.59 g/mol
Exact Mass187.01
IUPAC Name5-chloro-6-oxo-1H-pyridine-3-carbohydrazide
SMILESNNC(=O)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C6H6ClN3O2/c7-4-1-3(5(11)10-8)2-9-6(4)12/h1-2H,8H2,(H,9,12)(H,10,11)
InChIKeyQXAMTRGDJMWNPP-UHFFFAOYSA-N
XLogP-0.37
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.59
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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-chloro-6-oxo-N-(2-phenylethyl)-1H-pyridine-3-carboxamide
CID 110852311
N-(4-acetylphenyl)-5-chloro-6-oxo-1H-pyridine-3-carboxamide
CID 110861200
5-chloro-N-[(3-methylphenyl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 110850820
5-chloro-N-[4-(dimethylamino)phenyl]-6-oxo-1H-pyridine-3-carboxamide
CID 23795092
ethyl 3-(5-chloro-6-oxo-1H-pyridin-3-yl)-2-(ethylamino)-3-oxopropanoate
CID 70374427
4-bromo-3,5-dichlorobenzohydrazide
CID 169499880
N-[1-(4-bromophenyl)ethyl]-5-chloro-6-oxo-1H-pyridine-3-carboxamide
CID 47059465
5-chloro-N-(3-chlorophenyl)sulfonyl-6-oxo-1H-pyridine-3-carboxamide
CID 71939665
N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-6-oxo-1H-pyridine-3-carboxamide
CID 110851769
5-chloro-6-oxo-N-(4-propylphenyl)sulfonyl-1H-pyridine-3-carboxamide
CID 71890957
2-[2-[(5-chloro-6-oxo-1H-pyridine-3-carbonyl)amino]ethyl]-1,3-thiazole-4-carboxylic acid
CID 86285890
6-oxo-1H-pyridine-3-carbohydrazide
CID 11051863

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide?
The IUPAC name of 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide (CID 130843008) is 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide.
What is the SMILES notation for 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide?
The canonical SMILES for 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide is NNC(=O)c1c[nH]c(=O)c(Cl)c1.
What is the InChIKey of 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide?
The InChIKey is QXAMTRGDJMWNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClN3O2/c7-4-1-3(5(11)10-8)2-9-6(4)12/h1-2H,8H2,(H,9,12)(H,10,11).
What are the key properties of 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide?
5-chloro-6-oxo-1H-pyridine-3-carbohydrazide has a molecular weight of 187.59 g/mol, XLogP of -0.37, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-oxo-1H-pyridine-3-carbohydrazide is sourced from PubChem (CID 130843008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).