(1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride

C6H14Cl2N4 — CID 155821839

IUPAC(1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride
SMILESCC(C)n1ccc(NN)n1.Cl.Cl
InChIInChI=1S/C6H12N4.2ClH/c1-5(2)10-4-3-6(8-7)9-10;;/h3-5H,7H2,1-2H3,(H,8,9);2*1H
InChIKeyJDWRTZTVIUGSGM-UHFFFAOYSA-N
MW213.11 g/mol
LogP1.59
Rot. Bonds2

About (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride

(1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride (PubChem CID 155821839) has the molecular formula C6H14Cl2N4 and a molecular weight of 213.11 g/mol. Its IUPAC name is (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride.

Molecular Properties

Compound Name(1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride
PubChem CID155821839
Molecular FormulaC6H14Cl2N4
Molecular Weight213.11 g/mol
Exact Mass212.06
IUPAC Name(1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride
SMILESCC(C)n1ccc(NN)n1.Cl.Cl
InChIInChI=1S/C6H12N4.2ClH/c1-5(2)10-4-3-6(8-7)9-10;;/h3-5H,7H2,1-2H3,(H,8,9);2*1H
InChIKeyJDWRTZTVIUGSGM-UHFFFAOYSA-N
XLogP1.59
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.11
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-Methyl-2H-pyrazol-3-ylamine
CID 136927
1-Methyl-3-aminopyrazole
CID 137254
1-Ethyl-1H-pyrazol-5-amine
CID 337310
1-(propan-2-yl)-1H-pyrazol-5-amine
CID 1090341
1-ethyl-1H-pyrazol-3-amine
CID 12198109
1-(butan-2-yl)-1H-pyrazol-5-amine
CID 3762483
3-(3-Amino-1H-pyrazol-1-yl)propanenitrile
CID 12245933
1-(propan-2-yl)-1H-pyrazol-3-amine
CID 19576797
1-[2-(dimethylamino)ethyl]-1H-pyrazol-3-amine
CID 47002600
1-Butyl-1H-pyrazol-5-amine
CID 642216
3-azido-1-methyl-1H-pyrazole
CID 21680106
1-Propyl-1H-pyrazol-5-amine
CID 1084923

Frequently Asked Questions

What is the IUPAC name of (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride?
The IUPAC name of (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride (CID 155821839) is (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride.
What is the SMILES notation for (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride?
The canonical SMILES for (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride is CC(C)n1ccc(NN)n1.Cl.Cl.
What is the InChIKey of (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride?
The InChIKey is JDWRTZTVIUGSGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4.2ClH/c1-5(2)10-4-3-6(8-7)9-10;;/h3-5H,7H2,1-2H3,(H,8,9);2*1H.
What are the key properties of (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride?
(1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride has a molecular weight of 213.11 g/mol, XLogP of 1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propan-2-ylpyrazol-3-yl)hydrazine;dihydrochloride is sourced from PubChem (CID 155821839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).