[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine

C10H13ClN6 — CID 80968945

IUPAC[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(-n2cc(Cl)cn2)n1
InChIInChI=1S/C10H13ClN6/c1-6(2)10-14-8(16-12)3-9(15-10)17-5-7(11)4-13-17/h3-6H,12H2,1-2H3,(H,14,15,16)
InChIKeyCMAKWDJREKYCCG-UHFFFAOYSA-N
MW252.71 g/mol
LogP1.72
Rot. Bonds3

About [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine

[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 80968945) has the molecular formula C10H13ClN6 and a molecular weight of 252.71 g/mol. Its IUPAC name is [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID80968945
Molecular FormulaC10H13ClN6
Molecular Weight252.71 g/mol
Exact Mass252.09
IUPAC Name[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(-n2cc(Cl)cn2)n1
InChIInChI=1S/C10H13ClN6/c1-6(2)10-14-8(16-12)3-9(15-10)17-5-7(11)4-13-17/h3-6H,12H2,1-2H3,(H,14,15,16)
InChIKeyCMAKWDJREKYCCG-UHFFFAOYSA-N
XLogP1.72
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.71
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

6-(4-chloropyrazol-1-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80965622
[6-(4-chloropyrazol-1-yl)-2-cyclopropylpyrimidin-4-yl]hydrazine
CID 80968944
6-(4-chloropyrazol-1-yl)-N,2-dimethylpyrimidin-4-amine
CID 80856995
[2-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine
CID 80900186
[6-(3,5-dichlorophenoxy)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80979166
4-(4-bromopyrazol-1-yl)-6-hydrazinylpyrimidin-2-amine
CID 80901012
6-(4-chloro-3-methylpyrazol-1-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80965344
[6-(3,5-dimethylpiperidin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80969211
6-hydrazinyl-N-(3-methylbutyl)-2-propan-2-ylpyrimidin-4-amine
CID 80969046
N-(5-chloro-2-methylphenyl)-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968585
[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80963982
N-(2,6-dichlorophenyl)-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80969189

Frequently Asked Questions

What is the IUPAC name of [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (CID 80968945) is [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is CC(C)c1nc(NN)cc(-n2cc(Cl)cn2)n1.
What is the InChIKey of [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is CMAKWDJREKYCCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN6/c1-6(2)10-14-8(16-12)3-9(15-10)17-5-7(11)4-13-17/h3-6H,12H2,1-2H3,(H,14,15,16).
What are the key properties of [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 252.71 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80968945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).