[1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine

C12H20F2N4 — CID 105291188

IUPAC[1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCn1cc(CC(NN)C2CCC(F)(F)CC2)cn1
InChIInChI=1S/C12H20F2N4/c1-18-8-9(7-16-18)6-11(17-15)10-2-4-12(13,14)5-3-10/h7-8,10-11,17H,2-6,15H2,1H3
InChIKeyVNALUJKMFUTMDX-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.62
Rot. Bonds4

About [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine

[1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105291188) has the molecular formula C12H20F2N4 and a molecular weight of 258.32 g/mol. Its IUPAC name is [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105291188
Molecular FormulaC12H20F2N4
Molecular Weight258.32 g/mol
Exact Mass258.17
IUPAC Name[1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCn1cc(CC(NN)C2CCC(F)(F)CC2)cn1
InChIInChI=1S/C12H20F2N4/c1-18-8-9(7-16-18)6-11(17-15)10-2-4-12(13,14)5-3-10/h7-8,10-11,17H,2-6,15H2,1H3
InChIKeyVNALUJKMFUTMDX-UHFFFAOYSA-N
XLogP1.62
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.62
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-(3-ethylcyclopentyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105233556
1-(4,4-dimethylcyclohexyl)-N-ethyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 65392430
[1-(5-methyloxolan-3-yl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105291239
[1-(4,4-difluorocyclohexyl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105317373
1-cyclooctyl-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 80602955
[1-cycloheptyl-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025788
1-(4-tert-butylcyclohexyl)-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 65403165
[1-(4,4-difluorocyclohexyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105292742
1-(4-ethylcyclohexyl)-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 65393940
[2-(1-methylpyrazol-4-yl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105291195
[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(4,4-difluorocyclohexyl)ethyl]hydrazine
CID 105316856
N-[1-cyclohexyl-2-(1-methylpyrazol-4-yl)ethyl]propan-1-amine
CID 62126447

Frequently Asked Questions

What is the IUPAC name of [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine (CID 105291188) is [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine is Cn1cc(CC(NN)C2CCC(F)(F)CC2)cn1.
What is the InChIKey of [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is VNALUJKMFUTMDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F2N4/c1-18-8-9(7-16-18)6-11(17-15)10-2-4-12(13,14)5-3-10/h7-8,10-11,17H,2-6,15H2,1H3.
What are the key properties of [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine?
[1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 258.32 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4,4-difluorocyclohexyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105291188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).