[5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine

C9H11ClN6O — CID 81345793

IUPAC[5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine
SMILESCc1cc(Oc2nc(NN)ncc2Cl)n(C)n1
InChIInChI=1S/C9H11ClN6O/c1-5-3-7(16(2)15-5)17-8-6(10)4-12-9(13-8)14-11/h3-4H,11H2,1-2H3,(H,12,13,14)
InChIKeyVQZGKGQCCJUAJP-UHFFFAOYSA-N
MW254.68 g/mol
LogP1.25
Rot. Bonds3

About [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine

[5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine (PubChem CID 81345793) has the molecular formula C9H11ClN6O and a molecular weight of 254.68 g/mol. Its IUPAC name is [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine
PubChem CID81345793
Molecular FormulaC9H11ClN6O
Molecular Weight254.68 g/mol
Exact Mass254.07
IUPAC Name[5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine
SMILESCc1cc(Oc2nc(NN)ncc2Cl)n(C)n1
InChIInChI=1S/C9H11ClN6O/c1-5-3-7(16(2)15-5)17-8-6(10)4-12-9(13-8)14-11/h3-4H,11H2,1-2H3,(H,12,13,14)
InChIKeyVQZGKGQCCJUAJP-UHFFFAOYSA-N
XLogP1.25
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.68
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxypyridin-2-amine
CID 102761083
3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine
CID 102761085
4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine
CID 81345946
(5-chloro-4-methoxypyrimidin-2-yl)hydrazine
CID 80911079
[6-(2,5-dimethylpyrazol-3-yl)oxy-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 81345795
4-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-N-propylpyrimidin-2-amine
CID 81346874
[5-chloro-4-(2-chloro-4-fluorophenoxy)pyrimidin-2-yl]hydrazine
CID 80918493
3-bromo-5-chloro-2-(2,5-dimethylpyrazol-3-yl)oxypyridine
CID 114837815
[5-chloro-4-(3-methoxyphenoxy)pyrimidin-2-yl]hydrazine
CID 80914939
[4-(2-tert-butyl-4-methylphenoxy)-5-chloropyrimidin-2-yl]hydrazine
CID 80909592
(5-chloro-4-propan-2-yloxypyrimidin-2-yl)hydrazine
CID 80913433
[6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 81346637

Frequently Asked Questions

What is the IUPAC name of [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine?
The IUPAC name of [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine (CID 81345793) is [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine.
What is the SMILES notation for [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine?
The canonical SMILES for [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine is Cc1cc(Oc2nc(NN)ncc2Cl)n(C)n1.
What is the InChIKey of [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine?
The InChIKey is VQZGKGQCCJUAJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN6O/c1-5-3-7(16(2)15-5)17-8-6(10)4-12-9(13-8)14-11/h3-4H,11H2,1-2H3,(H,12,13,14).
What are the key properties of [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine?
[5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine has a molecular weight of 254.68 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-yl]hydrazine is sourced from PubChem (CID 81345793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).