[3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine

C12H22N4O — CID 103025690

IUPAC[3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine
SMILESCn1cc(CCC(NN)C2CCCCO2)cn1
InChIInChI=1S/C12H22N4O/c1-16-9-10(8-14-16)5-6-11(15-13)12-4-2-3-7-17-12/h8-9,11-12,15H,2-7,13H2,1H3
InChIKeyMGWRWIBOKIZAKO-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.75
Rot. Bonds5

About [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine

[3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine (PubChem CID 103025690) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine.

Molecular Properties

Compound Name[3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine
PubChem CID103025690
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine
SMILESCn1cc(CCC(NN)C2CCCCO2)cn1
InChIInChI=1S/C12H22N4O/c1-16-9-10(8-14-16)5-6-11(15-13)12-4-2-3-7-17-12/h8-9,11-12,15H,2-7,13H2,1H3
InChIKeyMGWRWIBOKIZAKO-UHFFFAOYSA-N
XLogP0.75
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.75
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'}

Analyze [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1-methyl-1H-pyrazol-4-yl)oxan-4-amine dihydrochloride
CID 119056955
4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-4-yl)pentan-2-amine
CID 103024991
4-Methoxy-4-methyl-1-(1-methylpyrazol-4-yl)pentan-2-amine
CID 103024992
[3-Methoxy-3-methyl-1-(1-propylpyrazol-4-yl)butyl]hydrazine
CID 103025203
[3-Methoxy-3-methyl-1-(1-methylpyrazol-4-yl)butyl]hydrazine
CID 103025204
[1-(1-Ethylpyrazol-4-yl)-3-methoxy-3-methylbutyl]hydrazine
CID 103025211
[4-Methoxy-4-methyl-1-(1-methylpyrazol-4-yl)pentan-2-yl]hydrazine
CID 103025217
[1-(1-Ethylpyrazol-4-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 103025218
[6-Ethoxy-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
CID 103025575
[1-(3-Methyloxolan-2-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025586
[3-(1-Methylpyrazol-4-yl)-1-(oxan-4-yl)propyl]hydrazine
CID 103025588
[1-Methoxy-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine
CID 103025598

Frequently Asked Questions

What is the IUPAC name of [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine?
The IUPAC name of [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine (CID 103025690) is [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine.
What is the SMILES notation for [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine?
The canonical SMILES for [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine is Cn1cc(CCC(NN)C2CCCCO2)cn1.
What is the InChIKey of [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine?
The InChIKey is MGWRWIBOKIZAKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-16-9-10(8-14-16)5-6-11(15-13)12-4-2-3-7-17-12/h8-9,11-12,15H,2-7,13H2,1H3.
What are the key properties of [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine?
[3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine has a molecular weight of 238.33 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-methylpyrazol-4-yl)-1-(oxan-2-yl)propyl]hydrazine is sourced from PubChem (CID 103025690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).