[2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine

C11H14F2N2 — CID 105196978

IUPAC[2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine
SMILESNNC(CC1CC1)c1ccc(F)c(F)c1
InChIInChI=1S/C11H14F2N2/c12-9-4-3-8(6-10(9)13)11(15-14)5-7-1-2-7/h3-4,6-7,11,15H,1-2,5,14H2
InChIKeyKWCQLEFBPWWIHC-UHFFFAOYSA-N
MW212.24 g/mol
LogP2.27
Rot. Bonds4

About [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine

[2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine (PubChem CID 105196978) has the molecular formula C11H14F2N2 and a molecular weight of 212.24 g/mol. Its IUPAC name is [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine
PubChem CID105196978
Molecular FormulaC11H14F2N2
Molecular Weight212.24 g/mol
Exact Mass212.11
IUPAC Name[2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine
SMILESNNC(CC1CC1)c1ccc(F)c(F)c1
InChIInChI=1S/C11H14F2N2/c12-9-4-3-8(6-10(9)13)11(15-14)5-7-1-2-7/h3-4,6-7,11,15H,1-2,5,14H2
InChIKeyKWCQLEFBPWWIHC-UHFFFAOYSA-N
XLogP2.27
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine?
The IUPAC name of [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine (CID 105196978) is [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine?
The canonical SMILES for [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine is NNC(CC1CC1)c1ccc(F)c(F)c1.
What is the InChIKey of [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine?
The InChIKey is KWCQLEFBPWWIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2/c12-9-4-3-8(6-10(9)13)11(15-14)5-7-1-2-7/h3-4,6-7,11,15H,1-2,5,14H2.
What are the key properties of [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine?
[2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine has a molecular weight of 212.24 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105196978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).