1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide

C14H11ClFN5O — CID 66889396

IUPAC1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide
SMILESNNC(=O)c1nn(Cc2ccc(Cl)cc2F)c2cccnc12
InChIInChI=1S/C14H11ClFN5O/c15-9-4-3-8(10(16)6-9)7-21-11-2-1-5-18-12(11)13(20-21)14(22)19-17/h1-6H,7,17H2,(H,19,22)
InChIKeyHLNCHDMGHPKZNY-UHFFFAOYSA-N
MW319.73 g/mol
LogP1.88
Rot. Bonds3

About 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide

1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide (PubChem CID 66889396) has the molecular formula C14H11ClFN5O and a molecular weight of 319.73 g/mol. Its IUPAC name is 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide.

Molecular Properties

Compound Name1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide
PubChem CID66889396
Molecular FormulaC14H11ClFN5O
Molecular Weight319.73 g/mol
Exact Mass319.06
IUPAC Name1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide
SMILESNNC(=O)c1nn(Cc2ccc(Cl)cc2F)c2cccnc12
InChIInChI=1S/C14H11ClFN5O/c15-9-4-3-8(10(16)6-9)7-21-11-2-1-5-18-12(11)13(20-21)14(22)19-17/h1-6H,7,17H2,(H,19,22)
InChIKeyHLNCHDMGHPKZNY-UHFFFAOYSA-N
XLogP1.88
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.73
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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'}

Analyze 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide 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

6-chloro-1-[(2,4-difluorophenyl)methyl]indazole-3-carbohydrazide
CID 11638599
1-[(2,4-dichlorophenyl)methyl]pyrazolo[3,4-b]pyrazine-3-carbohydrazide
CID 68913507
1-[(4-chloro-2-fluorophenyl)methyl]-6-(trifluoromethyl)indazole-3-carbohydrazide
CID 66889166
1-[[2-fluoro-4-(1-methylpyrazol-4-yl)phenyl]methyl]pyrazolo[4,3-b]pyridine-3-carboxylic acid;hydrochloride
CID 121452338
1-[(4-chloro-2-fluorophenyl)methyl]-6-fluoroindazole-3-carboxylic acid
CID 66888571
methyl 1-[[2,6-difluoro-4-(2-methoxyethoxy)phenyl]methyl]pyrazolo[4,3-b]pyridine-3-carboxylate
CID 130430062
1-[(2,4-difluorophenyl)methyl]-5-(trifluoromethyl)indazole-3-carbohydrazide
CID 11523569
methyl 1-[(4-chloro-2-fluorophenyl)methyl]-6-(hydroxymethyl)indazole-3-carboxylate
CID 66888548
1-[(2,4-dichlorophenyl)methyl]-N-(3,4-difluorophenyl)indazole-3-carboxamide
CID 11704695
1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide
CID 11537039
2-(4-chloro-2-fluorophenyl)acetohydrazide
CID 162677805
1-[(4-chloro-2-fluorophenyl)methyl]-6-methylsulfonylindazole-3-carboxylic acid
CID 91584953

Frequently Asked Questions

What is the IUPAC name of 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide?
The IUPAC name of 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide (CID 66889396) is 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide.
What is the SMILES notation for 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide?
The canonical SMILES for 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide is NNC(=O)c1nn(Cc2ccc(Cl)cc2F)c2cccnc12.
What is the InChIKey of 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide?
The InChIKey is HLNCHDMGHPKZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFN5O/c15-9-4-3-8(10(16)6-9)7-21-11-2-1-5-18-12(11)13(20-21)14(22)19-17/h1-6H,7,17H2,(H,19,22).
What are the key properties of 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide?
1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide has a molecular weight of 319.73 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chloro-2-fluorophenyl)methyl]pyrazolo[4,3-b]pyridine-3-carbohydrazide is sourced from PubChem (CID 66889396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).