[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine

C13H18F2N2O — CID 105219360

IUPAC[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
SMILESNNC(CCC1CCCO1)c1cc(F)ccc1F
InChIInChI=1S/C13H18F2N2O/c14-9-3-5-12(15)11(8-9)13(17-16)6-4-10-2-1-7-18-10/h3,5,8,10,13,17H,1-2,4,6-7,16H2
InChIKeyWLAGWYDTZJSGRB-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.43
Rot. Bonds5

About [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine

[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine (PubChem CID 105219360) has the molecular formula C13H18F2N2O and a molecular weight of 256.30 g/mol. Its IUPAC name is [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
PubChem CID105219360
Molecular FormulaC13H18F2N2O
Molecular Weight256.30 g/mol
Exact Mass256.14
IUPAC Name[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
SMILESNNC(CCC1CCCO1)c1cc(F)ccc1F
InChIInChI=1S/C13H18F2N2O/c14-9-3-5-12(15)11(8-9)13(17-16)6-4-10-2-1-7-18-10/h3,5,8,10,13,17H,1-2,4,6-7,16H2
InChIKeyWLAGWYDTZJSGRB-UHFFFAOYSA-N
XLogP2.43
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.43
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'}

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Related Compounds

[1-(2,5-dichlorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105302010
2-[3-bromo-3-(2,5-difluorophenyl)propyl]oxolane
CID 65158065
[1-(2-fluoro-4-methylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314262
[1-(2,4-dichlorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314231
1-(2,4-difluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 65160611
[1-(5-chloro-2-methylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314404
1-(2-chloro-5-fluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 105397716
[1-(6-fluoro-1-benzothiophen-2-yl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314280
[1-(2-fluoro-4-methoxyphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105256870
[1-(4-fluoro-3-methoxyphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314273
2-(2,5-difluorophenyl)-2-(oxolan-2-ylmethylamino)ethanol
CID 61048778
[1-(3-bromo-5-fluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105238607

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine?
The IUPAC name of [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine (CID 105219360) is [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine.
What is the SMILES notation for [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine?
The canonical SMILES for [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine is NNC(CCC1CCCO1)c1cc(F)ccc1F.
What is the InChIKey of [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine?
The InChIKey is WLAGWYDTZJSGRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F2N2O/c14-9-3-5-12(15)11(8-9)13(17-16)6-4-10-2-1-7-18-10/h3,5,8,10,13,17H,1-2,4,6-7,16H2.
What are the key properties of [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine?
[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine has a molecular weight of 256.30 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine is sourced from PubChem (CID 105219360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).