(5-chloro-1H-indazol-7-yl)methyl-ethyldiazene

C10H11ClN4 — CID 123947458

IUPAC(5-chloro-1H-indazol-7-yl)methyl-ethyldiazene
SMILESCC/N=N/Cc1cc(Cl)cc2cn[nH]c12
InChIInChI=1S/C10H11ClN4/c1-2-12-13-5-7-3-9(11)4-8-6-14-15-10(7)8/h3-4,6H,2,5H2,1H3,(H,14,15)/b13-12+
InChIKeyXZFGHEQCNDGYFN-OUKQBFOZSA-N
MW222.68 g/mol
LogP3.19
Rot. Bonds3

About (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene

(5-chloro-1H-indazol-7-yl)methyl-ethyldiazene (PubChem CID 123947458) has the molecular formula C10H11ClN4 and a molecular weight of 222.68 g/mol. Its IUPAC name is (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene.

Molecular Properties

Compound Name(5-chloro-1H-indazol-7-yl)methyl-ethyldiazene
PubChem CID123947458
Molecular FormulaC10H11ClN4
Molecular Weight222.68 g/mol
Exact Mass222.07
IUPAC Name(5-chloro-1H-indazol-7-yl)methyl-ethyldiazene
SMILESCC/N=N/Cc1cc(Cl)cc2cn[nH]c12
InChIInChI=1S/C10H11ClN4/c1-2-12-13-5-7-3-9(11)4-8-6-14-15-10(7)8/h3-4,6H,2,5H2,1H3,(H,14,15)/b13-12+
InChIKeyXZFGHEQCNDGYFN-OUKQBFOZSA-N
XLogP3.19
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

5-chloro-7-propan-2-yl-1H-indazole
CID 166818723
N-(5-chloro-1H-indazol-7-yl)acetamide
CID 119088127
1-(5-chloro-1H-indazol-7-yl)-2,2-dimethylpropan-1-ol
CID 134410251
7-tert-butyl-5-chloro-6-methyl-1H-indazole
CID 176638883
7-chloro-5-methylsulfanyl-1H-indazole
CID 167025504
(5-methyl-1H-indazol-7-yl)methanol
CID 76846426
ethyl 3-[(5-chloro-1H-indazole-7-carbonyl)amino]butanoate
CID 146187845
7-chloro-1H-indazole-5-carbonitrile
CID 66920531
3-(5-chloro-1H-indazol-7-yl)-1-nitrosoazetidin-3-ol
CID 142311919
2-(6,7-dimethyl-1H-indazol-5-yl)acetate
CID 18447211
1-(5-chloro-1H-indazol-7-yl)-3,3-dicyclopropylcyclobutan-1-ol
CID 134373219
(5-chloro-1H-indazol-7-yl)-cyclopentylmethanol
CID 134373345

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene?
The IUPAC name of (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene (CID 123947458) is (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene.
What is the SMILES notation for (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene?
The canonical SMILES for (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene is CC/N=N/Cc1cc(Cl)cc2cn[nH]c12.
What is the InChIKey of (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene?
The InChIKey is XZFGHEQCNDGYFN-OUKQBFOZSA-N. The full InChI is InChI=1S/C10H11ClN4/c1-2-12-13-5-7-3-9(11)4-8-6-14-15-10(7)8/h3-4,6H,2,5H2,1H3,(H,14,15)/b13-12+.
What are the key properties of (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene?
(5-chloro-1H-indazol-7-yl)methyl-ethyldiazene has a molecular weight of 222.68 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1H-indazol-7-yl)methyl-ethyldiazene is sourced from PubChem (CID 123947458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).