[1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine

C8H14F2N4 — CID 103027033

IUPAC[1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine
SMILESCn1cc(CCC(NN)C(F)F)cn1
InChIInChI=1S/C8H14F2N4/c1-14-5-6(4-12-14)2-3-7(13-11)8(9)10/h4-5,7-8,13H,2-3,11H2,1H3
InChIKeyCQCLLICTUDCKCJ-UHFFFAOYSA-N
MW204.22 g/mol
LogP0.45
Rot. Bonds5

About [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine

[1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine (PubChem CID 103027033) has the molecular formula C8H14F2N4 and a molecular weight of 204.22 g/mol. Its IUPAC name is [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine
PubChem CID103027033
Molecular FormulaC8H14F2N4
Molecular Weight204.22 g/mol
Exact Mass204.12
IUPAC Name[1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine
SMILESCn1cc(CCC(NN)C(F)F)cn1
InChIInChI=1S/C8H14F2N4/c1-14-5-6(4-12-14)2-3-7(13-11)8(9)10/h4-5,7-8,13H,2-3,11H2,1H3
InChIKeyCQCLLICTUDCKCJ-UHFFFAOYSA-N
XLogP0.45
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.22
LogP ≤ 50.45
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'}

Analyze [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]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

1-methyl-4-(pyrrolidin-2-yl)-1H-pyrazole
CID 25248267
2-(1-methyl-1H-pyrazol-4-yl)piperidine
CID 63085164
alpha-Ethyl-1-methyl-1H-pyrazole-4-methanamine
CID 23005813
2,2,2-trifluoro-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-amine
CID 43124155
2-methyl-1-(1-methyl-1H-pyrazol-4-yl)propan-1-amine
CID 43124222
alpha,1-Dimethyl-1H-pyrazole-4-ethanamine
CID 43199853
3-(1-methyl-1H-pyrazol-4-yl)propan-1-amine
CID 47003365
cyclobutyl(1-methyl-1H-pyrazol-4-yl)methanamine
CID 43124235
4-(1-methyl-1H-pyrazol-4-yl)butan-1-amine
CID 50988989
4-(1-methyl-1H-pyrazol-4-yl)butan-2-amine
CID 62127805
2-methyl-3-(1-methyl-1H-pyrazol-4-yl)propan-1-amine
CID 62505178
3-(1-methyl-1H-pyrazol-4-yl)propan-1-amine dihydrochloride
CID 90482959

Frequently Asked Questions

What is the IUPAC name of [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine?
The IUPAC name of [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine (CID 103027033) is [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine.
What is the SMILES notation for [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine?
The canonical SMILES for [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine is Cn1cc(CCC(NN)C(F)F)cn1.
What is the InChIKey of [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine?
The InChIKey is CQCLLICTUDCKCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2N4/c1-14-5-6(4-12-14)2-3-7(13-11)8(9)10/h4-5,7-8,13H,2-3,11H2,1H3.
What are the key properties of [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine?
[1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine has a molecular weight of 204.22 g/mol, XLogP of 0.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1,1-difluoro-4-(1-methylpyrazol-4-yl)butan-2-yl]hydrazine is sourced from PubChem (CID 103027033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).