[1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride

C8H16Cl2N4O — CID 138040608

IUPAC[1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride
SMILESCl.Cl.NNc1ccn(C2CCOCC2)n1
InChIInChI=1S/C8H14N4O.2ClH/c9-10-8-1-4-12(11-8)7-2-5-13-6-3-7;;/h1,4,7H,2-3,5-6,9H2,(H,10,11);2*1H
InChIKeyDVBKPZDELQONSZ-UHFFFAOYSA-N
MW255.15 g/mol
LogP1.36
Rot. Bonds2

About [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride

[1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride (PubChem CID 138040608) has the molecular formula C8H16Cl2N4O and a molecular weight of 255.15 g/mol. Its IUPAC name is [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride.

Molecular Properties

Compound Name[1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride
PubChem CID138040608
Molecular FormulaC8H16Cl2N4O
Molecular Weight255.15 g/mol
Exact Mass254.07
IUPAC Name[1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride
SMILESCl.Cl.NNc1ccn(C2CCOCC2)n1
InChIInChI=1S/C8H14N4O.2ClH/c9-10-8-1-4-12(11-8)7-2-5-13-6-3-7;;/h1,4,7H,2-3,5-6,9H2,(H,10,11);2*1H
InChIKeyDVBKPZDELQONSZ-UHFFFAOYSA-N
XLogP1.36
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.15
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

1-[(Oxan-4-yl)methyl]-1H-pyrazol-3-amine
CID 62385497
1-(oxan-4-yl)-1H-pyrazol-3-amine
CID 63937838
1-(oxan-3-yl)-1H-pyrazol-3-amine
CID 84652730
1-(3-methoxypropyl)-N-(oxan-4-yl)pyrazol-3-amine
CID 71918463
3-hydrazinyl-1-(2-methoxyethyl)-1H-pyrazole dihydrochloride
CID 138040445
3-hydrazinyl-1-(propan-2-yl)-1H-pyrazole dihydrochloride
CID 155821839
1-[1-[3-(2,2,2-Trifluoroethoxy)propyl]piperidin-4-yl]pyrazol-3-amine
CID 107109658
[1-(Oxan-4-yl)pyrazol-3-yl]hydrazine
CID 138040609
1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-5-amine
CID 43608662
1-methyl-N-(oxan-4-yl)-1H-pyrazol-3-amine
CID 60810299
1-(oxan-2-yl)-1H-pyrazol-3-amine
CID 90437225
N-[2-(oxan-4-yl)pyrazol-3-yl]methanimine
CID 90885828

Frequently Asked Questions

What is the IUPAC name of [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride?
The IUPAC name of [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride (CID 138040608) is [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride.
What is the SMILES notation for [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride?
The canonical SMILES for [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride is Cl.Cl.NNc1ccn(C2CCOCC2)n1.
What is the InChIKey of [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride?
The InChIKey is DVBKPZDELQONSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O.2ClH/c9-10-8-1-4-12(11-8)7-2-5-13-6-3-7;;/h1,4,7H,2-3,5-6,9H2,(H,10,11);2*1H.
What are the key properties of [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride?
[1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride has a molecular weight of 255.15 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxan-4-yl)pyrazol-3-yl]hydrazine;dihydrochloride is sourced from PubChem (CID 138040608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).