1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine

C10H10F2N2O — CID 105315471

IUPAC1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine
SMILESC#CC(NN)c1ccccc1OC(F)F
InChIInChI=1S/C10H10F2N2O/c1-2-8(14-13)7-5-3-4-6-9(7)15-10(11)12/h1,3-6,8,10,14H,13H2
InChIKeyUNMRIDIKSTYMJO-UHFFFAOYSA-N
MW212.20 g/mol
LogP1.43
Rot. Bonds4

About 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine

1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine (PubChem CID 105315471) has the molecular formula C10H10F2N2O and a molecular weight of 212.20 g/mol. Its IUPAC name is 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine.

Molecular Properties

Compound Name1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine
PubChem CID105315471
Molecular FormulaC10H10F2N2O
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Name1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine
SMILESC#CC(NN)c1ccccc1OC(F)F
InChIInChI=1S/C10H10F2N2O/c1-2-8(14-13)7-5-3-4-6-9(7)15-10(11)12/h1,3-6,8,10,14H,13H2
InChIKeyUNMRIDIKSTYMJO-UHFFFAOYSA-N
XLogP1.43
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

[1-[2-(difluoromethoxy)phenyl]-2,2-dimethylpropyl]hydrazine
CID 105305256
1-[2-(difluoromethoxy)phenyl]pent-3-ynylhydrazine
CID 105290570
N-[1-[2-(difluoromethoxy)phenyl]ethyl]pent-1-yn-3-amine
CID 106225024
[[2-(difluoromethoxy)phenyl]-(3-fluorophenyl)methyl]hydrazine
CID 105285492
1-[2-(difluoromethoxy)phenyl]hexylhydrazine
CID 105294561
(1S)-1-[2-(difluoromethoxy)phenyl]ethane-1,2-diamine
CID 66517155
1-[2-(difluoromethoxy)phenyl]pent-4-yn-1-ol
CID 63894225
[[2-(difluoromethoxy)phenyl]-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105302409
1-(1-chloroethyl)-2-(difluoromethoxy)benzene
CID 43114935
1-(2,4-dimethoxyphenyl)prop-2-ynylhydrazine
CID 105315555
(1S)-1-[2-(difluoromethoxy)phenyl]-2,2,2-trifluoroethanamine;hydrochloride
CID 171250237
[[2-(difluoromethoxy)phenyl]-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105288032

Frequently Asked Questions

What is the IUPAC name of 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine?
The IUPAC name of 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine (CID 105315471) is 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine.
What is the SMILES notation for 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine?
The canonical SMILES for 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine is C#CC(NN)c1ccccc1OC(F)F.
What is the InChIKey of 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine?
The InChIKey is UNMRIDIKSTYMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2O/c1-2-8(14-13)7-5-3-4-6-9(7)15-10(11)12/h1,3-6,8,10,14H,13H2.
What are the key properties of 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine?
1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine has a molecular weight of 212.20 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(difluoromethoxy)phenyl]prop-2-ynylhydrazine is sourced from PubChem (CID 105315471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).