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

C11H18F2N4 — CID 105288751

IUPAC[(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
SMILESCn1cc(C(NN)C2CCC(F)(F)CC2)cn1
InChIInChI=1S/C11H18F2N4/c1-17-7-9(6-15-17)10(16-14)8-2-4-11(12,13)5-3-8/h6-8,10,16H,2-5,14H2,1H3
InChIKeyZVOODWBNJWVDQP-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.75
Rot. Bonds3

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

[(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine (PubChem CID 105288751) has the molecular formula C11H18F2N4 and a molecular weight of 244.29 g/mol. Its IUPAC name is [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
PubChem CID105288751
Molecular FormulaC11H18F2N4
Molecular Weight244.29 g/mol
Exact Mass244.15
IUPAC Name[(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
SMILESCn1cc(C(NN)C2CCC(F)(F)CC2)cn1
InChIInChI=1S/C11H18F2N4/c1-17-7-9(6-15-17)10(16-14)8-2-4-11(12,13)5-3-8/h6-8,10,16H,2-5,14H2,1H3
InChIKeyZVOODWBNJWVDQP-UHFFFAOYSA-N
XLogP1.75
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.75
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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Frequently Asked Questions

What is the IUPAC name of [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
The IUPAC name of [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine (CID 105288751) is [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine is Cn1cc(C(NN)C2CCC(F)(F)CC2)cn1.
What is the InChIKey of [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
The InChIKey is ZVOODWBNJWVDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F2N4/c1-17-7-9(6-15-17)10(16-14)8-2-4-11(12,13)5-3-8/h6-8,10,16H,2-5,14H2,1H3.
What are the key properties of [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
[(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine has a molecular weight of 244.29 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4,4-difluorocyclohexyl)-(1-methylpyrazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105288751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).