[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine

C12H16F2N2O — CID 105198582

IUPAC[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCO1)c1cccc(F)c1F
InChIInChI=1S/C12H16F2N2O/c13-10-5-1-4-9(12(10)14)11(16-15)7-8-3-2-6-17-8/h1,4-5,8,11,16H,2-3,6-7,15H2
InChIKeyAVGHKLCAEQWPEY-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.04
Rot. Bonds4

About [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine

[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine (PubChem CID 105198582) has the molecular formula C12H16F2N2O and a molecular weight of 242.27 g/mol. Its IUPAC name is [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine
PubChem CID105198582
Molecular FormulaC12H16F2N2O
Molecular Weight242.27 g/mol
Exact Mass242.12
IUPAC Name[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCO1)c1cccc(F)c1F
InChIInChI=1S/C12H16F2N2O/c13-10-5-1-4-9(12(10)14)11(16-15)7-8-3-2-6-17-8/h1,4-5,8,11,16H,2-3,6-7,15H2
InChIKeyAVGHKLCAEQWPEY-UHFFFAOYSA-N
XLogP2.04
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 52.04
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'}

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Related Compounds

[2-cyclopentyl-1-(2,3-difluorophenyl)ethyl]hydrazine
CID 105299116
[1-(2-methylphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267276
[1-(4-bromo-3-chloro-2-fluorophenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 106765387
[1-(2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267281
[2-(oxolan-2-yl)-1-(2-propoxyphenyl)ethyl]hydrazine
CID 105198546
[1-(furan-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198479
[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267339
[2-cyclobutyl-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105310166
1-(2,3-difluorophenyl)-N-(oxan-2-ylmethyl)ethanamine
CID 103915785
[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105219360
[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
CID 105329262
[2-(oxolan-2-yl)-1-(3-propan-2-yloxyphenyl)ethyl]hydrazine
CID 105198673

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine?
The IUPAC name of [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine (CID 105198582) is [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine is NNC(CC1CCCO1)c1cccc(F)c1F.
What is the InChIKey of [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine?
The InChIKey is AVGHKLCAEQWPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F2N2O/c13-10-5-1-4-9(12(10)14)11(16-15)7-8-3-2-6-17-8/h1,4-5,8,11,16H,2-3,6-7,15H2.
What are the key properties of [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine?
[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine has a molecular weight of 242.27 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105198582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).