[(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

C14H21F3N4 — CID 105247407

IUPAC[(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCN1CCN(C)C(C(NN)c2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C14H21F3N4/c1-20-6-7-21(2)12(9-20)13(19-18)10-4-3-5-11(8-10)14(15,16)17/h3-5,8,12-13,19H,6-7,9,18H2,1-2H3
InChIKeyIDLZVLAOOXLYAX-UHFFFAOYSA-N
MW302.34 g/mol
LogP1.46
Rot. Bonds3

About [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

[(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105247407) has the molecular formula C14H21F3N4 and a molecular weight of 302.34 g/mol. Its IUPAC name is [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105247407
Molecular FormulaC14H21F3N4
Molecular Weight302.34 g/mol
Exact Mass302.17
IUPAC Name[(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCN1CCN(C)C(C(NN)c2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C14H21F3N4/c1-20-6-7-21(2)12(9-20)13(19-18)10-4-3-5-11(8-10)14(15,16)17/h3-5,8,12-13,19H,6-7,9,18H2,1-2H3
InChIKeyIDLZVLAOOXLYAX-UHFFFAOYSA-N
XLogP1.46
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 51.46
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

[1,4-diazabicyclo[2.2.2]octan-2-yl-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105250081
[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine
CID 105247429
[(1,4-dimethylpiperazin-2-yl)-(4-methylphenyl)methyl]hydrazine
CID 105247203
[cyclopropyl-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193820
[cyclobutyl-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193958
2-(4-methylpiperazin-1-yl)-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 16792620
[(5,6-dimethyl-1,4-dithian-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 103347136
[(4-chlorophenyl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261246
[(1,4-dimethylpiperazin-2-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105247174
N-[1-[3-(trifluoromethyl)phenyl]ethyl]-1-azabicyclo[2.2.2]octan-3-amine
CID 43195070
1-(1,4-dimethylpiperazin-2-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]methanamine
CID 63896516
[2,2,2-trifluoro-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 53402398

Frequently Asked Questions

What is the IUPAC name of [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105247407) is [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is CN1CCN(C)C(C(NN)c2cccc(C(F)(F)F)c2)C1.
What is the InChIKey of [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is IDLZVLAOOXLYAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21F3N4/c1-20-6-7-21(2)12(9-20)13(19-18)10-4-3-5-11(8-10)14(15,16)17/h3-5,8,12-13,19H,6-7,9,18H2,1-2H3.
What are the key properties of [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
[(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 302.34 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105247407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).