8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide

C7H6ClN5O — CID 141408708

IUPAC8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide
SMILESNNC(=O)c1nnc2c(Cl)cccn12
InChIInChI=1S/C7H6ClN5O/c8-4-2-1-3-13-5(4)11-12-6(13)7(14)10-9/h1-3H,9H2,(H,10,14)
InChIKeyRRVOLWBTZZMJGD-UHFFFAOYSA-N
MW211.61 g/mol
LogP-0.01
Rot. Bonds1

About 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide

8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide (PubChem CID 141408708) has the molecular formula C7H6ClN5O and a molecular weight of 211.61 g/mol. Its IUPAC name is 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide.

Molecular Properties

Compound Name8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide
PubChem CID141408708
Molecular FormulaC7H6ClN5O
Molecular Weight211.61 g/mol
Exact Mass211.03
IUPAC Name8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide
SMILESNNC(=O)c1nnc2c(Cl)cccn12
InChIInChI=1S/C7H6ClN5O/c8-4-2-1-3-13-5(4)11-12-6(13)7(14)10-9/h1-3H,9H2,(H,10,14)
InChIKeyRRVOLWBTZZMJGD-UHFFFAOYSA-N
XLogP-0.01
TPSA85.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.61
LogP ≤ 5-0.01
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'}

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Related Compounds

8-chloro-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 82529717
6-benzylsulfanyl-8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide;ethane
CID 177049442
8-chloro-3-(methylsulfonylmethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117257396
3-tert-butyl-8-chloro-[1,2,4]triazolo[4,3-a]pyridine
CID 15754777
8-chloroimidazo[1,2-a]pyridine-3-carboximidamide
CID 83879193
[4-(8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperazin-1-yl]-phenylmethanone
CID 53203708
1-(8-chloroimidazo[1,2-a]pyridin-3-yl)propan-2-one
CID 83884133
2-amino-6-chlorobenzohydrazide;ethane
CID 145125015
8-chloro-3-(furan-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117147341
8-[(2,6-dichlorobenzoyl)amino]-3-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 54366359
(8-chloroimidazo[1,2-a]pyridin-3-yl)methanamine
CID 55266455
3-chloro-2-hydroxybenzohydrazide;hydrochloride
CID 130771033

Frequently Asked Questions

What is the IUPAC name of 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide?
The IUPAC name of 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide (CID 141408708) is 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide.
What is the SMILES notation for 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide?
The canonical SMILES for 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide is NNC(=O)c1nnc2c(Cl)cccn12.
What is the InChIKey of 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide?
The InChIKey is RRVOLWBTZZMJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN5O/c8-4-2-1-3-13-5(4)11-12-6(13)7(14)10-9/h1-3H,9H2,(H,10,14).
What are the key properties of 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide?
8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide has a molecular weight of 211.61 g/mol, XLogP of -0.01, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbohydrazide is sourced from PubChem (CID 141408708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).