[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine

C13H22N4O — CID 105322157

IUPAC[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
SMILESCn1nccc1C(NN)C1CCOC2(CCC2)C1
InChIInChI=1S/C13H22N4O/c1-17-11(3-7-15-17)12(16-14)10-4-8-18-13(9-10)5-2-6-13/h3,7,10,12,16H,2,4-6,8-9,14H2,1H3
InChIKeyRRYYMYCOIVQJBE-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.27
Rot. Bonds3

About [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine

[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine (PubChem CID 105322157) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
PubChem CID105322157
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
SMILESCn1nccc1C(NN)C1CCOC2(CCC2)C1
InChIInChI=1S/C13H22N4O/c1-17-11(3-7-15-17)12(16-14)10-4-8-18-13(9-10)5-2-6-13/h3,7,10,12,16H,2,4-6,8-9,14H2,1H3
InChIKeyRRYYMYCOIVQJBE-UHFFFAOYSA-N
XLogP1.27
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.27
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

N-[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]ethanamine
CID 105166196
N-[(2-methylpyrazol-3-yl)-(6-oxaspiro[4.5]decan-9-yl)methyl]propan-1-amine
CID 105170255
[(2-methylpyrazol-3-yl)-(oxolan-3-yl)methyl]hydrazine
CID 105229276
[(2,5-dimethylpyrazol-3-yl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325481
[cyclopentyl-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105204250
4-[hydrazinyl(1-oxaspiro[5.5]undecan-4-yl)methyl]-1-methylpyrazol-5-amine
CID 105230964
[(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232404
[(4-methyl-3-pyridinyl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105279930
[(2-methylcyclopentyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 107193950
[(2-methylpyrazol-3-yl)-spiro[2.2]pentan-2-ylmethyl]hydrazine
CID 164651892
(2-methylpyrazol-3-yl)-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)methanol
CID 114554117
[6-oxaspiro[4.5]decan-9-yl(pyridin-3-yl)methyl]hydrazine
CID 105196290

Frequently Asked Questions

What is the IUPAC name of [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The IUPAC name of [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine (CID 105322157) is [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine.
What is the SMILES notation for [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The canonical SMILES for [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine is Cn1nccc1C(NN)C1CCOC2(CCC2)C1.
What is the InChIKey of [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The InChIKey is RRYYMYCOIVQJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-17-11(3-7-15-17)12(16-14)10-4-8-18-13(9-10)5-2-6-13/h3,7,10,12,16H,2,4-6,8-9,14H2,1H3.
What are the key properties of [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine has a molecular weight of 250.35 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine is sourced from PubChem (CID 105322157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).