[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine

C15H23FN2O2 — CID 105329262

IUPAC[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
SMILESCOc1cccc(C(CCC2CCCCO2)NN)c1F
InChIInChI=1S/C15H23FN2O2/c1-19-14-7-4-6-12(15(14)16)13(18-17)9-8-11-5-2-3-10-20-11/h4,6-7,11,13,18H,2-3,5,8-10,17H2,1H3
InChIKeyLDDNMUHTTXQRJR-UHFFFAOYSA-N
MW282.36 g/mol
LogP2.69
Rot. Bonds6

About [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine

[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine (PubChem CID 105329262) has the molecular formula C15H23FN2O2 and a molecular weight of 282.36 g/mol. Its IUPAC name is [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
PubChem CID105329262
Molecular FormulaC15H23FN2O2
Molecular Weight282.36 g/mol
Exact Mass282.17
IUPAC Name[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
SMILESCOc1cccc(C(CCC2CCCCO2)NN)c1F
InChIInChI=1S/C15H23FN2O2/c1-19-14-7-4-6-12(15(14)16)13(18-17)9-8-11-5-2-3-10-20-11/h4,6-7,11,13,18H,2-3,5,8-10,17H2,1H3
InChIKeyLDDNMUHTTXQRJR-UHFFFAOYSA-N
XLogP2.69
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 52.69
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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Related Compounds

1-(2-fluoro-3-methoxyphenyl)-4-(oxan-2-yl)butan-2-amine
CID 105035512
[1-(2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267281
[1-(2-fluoro-4-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
CID 103397792
[2-cycloheptyl-1-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105329278
[1-(4-fluoro-3-methoxyphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314273
[1-(4-chloro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
CID 105320716
[3-(oxan-2-yl)-1-[2-(trifluoromethyl)phenyl]propyl]hydrazine
CID 105304775
[1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314298
[1-(2-fluoro-4-methoxyphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105256870
N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine
CID 65166709
[1-(2-methylthiophen-3-yl)-3-(oxan-2-yl)propyl]hydrazine
CID 102843428
[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105219360

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine?
The IUPAC name of [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine (CID 105329262) is [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine?
The canonical SMILES for [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine is COc1cccc(C(CCC2CCCCO2)NN)c1F.
What is the InChIKey of [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine?
The InChIKey is LDDNMUHTTXQRJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O2/c1-19-14-7-4-6-12(15(14)16)13(18-17)9-8-11-5-2-3-10-20-11/h4,6-7,11,13,18H,2-3,5,8-10,17H2,1H3.
What are the key properties of [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine?
[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine has a molecular weight of 282.36 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine is sourced from PubChem (CID 105329262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).