[4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine

C12H22N4O — CID 103027042

IUPAC[4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine
SMILESCn1nccc1CCC(CC1CCOC1)NN
InChIInChI=1S/C12H22N4O/c1-16-12(4-6-14-16)3-2-11(15-13)8-10-5-7-17-9-10/h4,6,10-11,15H,2-3,5,7-9,13H2,1H3
InChIKeyYKXVYCDTPMKHJQ-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.61
Rot. Bonds6

About [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine

[4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine (PubChem CID 103027042) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine
PubChem CID103027042
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine
SMILESCn1nccc1CCC(CC1CCOC1)NN
InChIInChI=1S/C12H22N4O/c1-16-12(4-6-14-16)3-2-11(15-13)8-10-5-7-17-9-10/h4,6,10-11,15H,2-3,5,7-9,13H2,1H3
InChIKeyYKXVYCDTPMKHJQ-UHFFFAOYSA-N
XLogP0.61
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.61
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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Frequently Asked Questions

What is the IUPAC name of [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine?
The IUPAC name of [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine (CID 103027042) is [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine.
What is the SMILES notation for [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine?
The canonical SMILES for [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine is Cn1nccc1CCC(CC1CCOC1)NN.
What is the InChIKey of [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine?
The InChIKey is YKXVYCDTPMKHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-16-12(4-6-14-16)3-2-11(15-13)8-10-5-7-17-9-10/h4,6,10-11,15H,2-3,5,7-9,13H2,1H3.
What are the key properties of [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine?
[4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine has a molecular weight of 238.33 g/mol, XLogP of 0.61, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)butan-2-yl]hydrazine is sourced from PubChem (CID 103027042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).