[3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine

C7H11F3N4 — CID 105205906

IUPAC[3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine
SMILESCn1cc(C(CC(F)(F)F)NN)cn1
InChIInChI=1S/C7H11F3N4/c1-14-4-5(3-12-14)6(13-11)2-7(8,9)10/h3-4,6,13H,2,11H2,1H3
InChIKeyUDSBCJYVTKLOPP-UHFFFAOYSA-N
MW208.19 g/mol
LogP0.88
Rot. Bonds3

About [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine

[3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine (PubChem CID 105205906) has the molecular formula C7H11F3N4 and a molecular weight of 208.19 g/mol. Its IUPAC name is [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine.

Molecular Properties

Compound Name[3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine
PubChem CID105205906
Molecular FormulaC7H11F3N4
Molecular Weight208.19 g/mol
Exact Mass208.09
IUPAC Name[3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine
SMILESCn1cc(C(CC(F)(F)F)NN)cn1
InChIInChI=1S/C7H11F3N4/c1-14-4-5(3-12-14)6(13-11)2-7(8,9)10/h3-4,6,13H,2,11H2,1H3
InChIKeyUDSBCJYVTKLOPP-UHFFFAOYSA-N
XLogP0.88
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 50.88
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'}

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Related Compounds

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
(1R,2S)-2-(1-Methyl-1H-pyrazol-4-yl)cyclopropan-1-amine
CID 91647634
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
2,2,2-trifluoro-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-amine dihydrochloride
CID 165940970
1-(1-ethyl-1H-pyrazol-4-yl)propan-1-amine
CID 23005819

Frequently Asked Questions

What is the IUPAC name of [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine?
The IUPAC name of [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine (CID 105205906) is [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine.
What is the SMILES notation for [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine?
The canonical SMILES for [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine is Cn1cc(C(CC(F)(F)F)NN)cn1.
What is the InChIKey of [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine?
The InChIKey is UDSBCJYVTKLOPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3N4/c1-14-4-5(3-12-14)6(13-11)2-7(8,9)10/h3-4,6,13H,2,11H2,1H3.
What are the key properties of [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine?
[3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine has a molecular weight of 208.19 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3,3,3-trifluoro-1-(1-methylpyrazol-4-yl)propyl]hydrazine is sourced from PubChem (CID 105205906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).