(5-fluoro-2-hexoxyphenyl)methylidenehydrazine

C13H19FN2O — CID 168529261

IUPAC(5-fluoro-2-hexoxyphenyl)methylidenehydrazine
SMILESCCCCCCOc1ccc(F)cc1C=NN
InChIInChI=1S/C13H19FN2O/c1-2-3-4-5-8-17-13-7-6-12(14)9-11(13)10-16-15/h6-7,9-10H,2-5,8,15H2,1H3
InChIKeyAEJOVLNLMVXHDB-UHFFFAOYSA-N
MW238.31 g/mol
LogP3.08
Rot. Bonds7

About (5-fluoro-2-hexoxyphenyl)methylidenehydrazine

(5-fluoro-2-hexoxyphenyl)methylidenehydrazine (PubChem CID 168529261) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is (5-fluoro-2-hexoxyphenyl)methylidenehydrazine.

Molecular Properties

Compound Name(5-fluoro-2-hexoxyphenyl)methylidenehydrazine
PubChem CID168529261
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC Name(5-fluoro-2-hexoxyphenyl)methylidenehydrazine
SMILESCCCCCCOc1ccc(F)cc1C=NN
InChIInChI=1S/C13H19FN2O/c1-2-3-4-5-8-17-13-7-6-12(14)9-11(13)10-16-15/h6-7,9-10H,2-5,8,15H2,1H3
InChIKeyAEJOVLNLMVXHDB-UHFFFAOYSA-N
XLogP3.08
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-fluoro-2-octoxyaniline
CID 43128998
1,4-difluoro-2-hexoxybenzene
CID 23437312
2,4-difluoro-1-octadec-9-enoxybenzene
CID 173351130
5-fluoro-2-nonoxybenzoic acid
CID 115297915
(3-methyl-4-pentoxyphenyl)methylidenehydrazine
CID 168529268
(5-fluoro-2-hexoxyphenyl)methanol
CID 91657337
trifluoro-(5-fluoro-2-hexoxyphenyl)boranuide
CID 63703027
(3,4-difluoro-5-pentoxyphenyl)methylidenehydrazine
CID 168529285
1-chloro-4-fluoro-2-octoxybenzene
CID 114264358
(1R)-1-(5-fluoro-2-pentoxyphenyl)ethanamine
CID 63370186
2,3-difluoro-1,4-dihexoxybenzene
CID 125465685
5-fluoro-2-pentoxybenzoyl chloride
CID 91655742

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-2-hexoxyphenyl)methylidenehydrazine?
The IUPAC name of (5-fluoro-2-hexoxyphenyl)methylidenehydrazine (CID 168529261) is (5-fluoro-2-hexoxyphenyl)methylidenehydrazine.
What is the SMILES notation for (5-fluoro-2-hexoxyphenyl)methylidenehydrazine?
The canonical SMILES for (5-fluoro-2-hexoxyphenyl)methylidenehydrazine is CCCCCCOc1ccc(F)cc1C=NN.
What is the InChIKey of (5-fluoro-2-hexoxyphenyl)methylidenehydrazine?
The InChIKey is AEJOVLNLMVXHDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-2-3-4-5-8-17-13-7-6-12(14)9-11(13)10-16-15/h6-7,9-10H,2-5,8,15H2,1H3.
What are the key properties of (5-fluoro-2-hexoxyphenyl)methylidenehydrazine?
(5-fluoro-2-hexoxyphenyl)methylidenehydrazine has a molecular weight of 238.31 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-2-hexoxyphenyl)methylidenehydrazine is sourced from PubChem (CID 168529261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).