1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine

C19H24F2N2O — CID 169384804

IUPAC1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine
SMILESCCCCCCOc1c(F)cc(F)cc1CNNc1ccccc1
InChIInChI=1S/C19H24F2N2O/c1-2-3-4-8-11-24-19-15(12-16(20)13-18(19)21)14-22-23-17-9-6-5-7-10-17/h5-7,9-10,12-13,22-23H,2-4,8,11,14H2,1H3
InChIKeyYVICOQFMPCONTH-UHFFFAOYSA-N
MW334.41 g/mol
LogP5.04
Rot. Bonds10

About 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine

1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine (PubChem CID 169384804) has the molecular formula C19H24F2N2O and a molecular weight of 334.41 g/mol. Its IUPAC name is 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine
PubChem CID169384804
Molecular FormulaC19H24F2N2O
Molecular Weight334.41 g/mol
Exact Mass334.19
IUPAC Name1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine
SMILESCCCCCCOc1c(F)cc(F)cc1CNNc1ccccc1
InChIInChI=1S/C19H24F2N2O/c1-2-3-4-8-11-24-19-15(12-16(20)13-18(19)21)14-22-23-17-9-6-5-7-10-17/h5-7,9-10,12-13,22-23H,2-4,8,11,14H2,1H3
InChIKeyYVICOQFMPCONTH-UHFFFAOYSA-N
XLogP5.04
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.41
LogP ≤ 55.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[(2-ethoxy-3,5-difluorophenyl)methyl]-2-phenylhydrazine
CID 169385910
1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine
CID 169384787
1-[(3,5-difluoro-4-propoxyphenyl)methyl]-2-phenylhydrazine
CID 169384890
(3,5-difluoro-2-hexoxyphenyl)methanol
CID 91658009
1-[(3,4-difluoro-5-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384801
N-[(3,5-difluoro-2-hexoxyphenyl)methylideneamino]aniline
CID 169381904
1-[(5-methyl-2-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384807
1-[(4-butoxy-2,6-difluorophenyl)methyl]-2-phenylhydrazine
CID 169385920
1-[(2-bromo-3,5-difluorophenyl)methyl]-2-phenylhydrazine
CID 169384645
1,3-difluoro-2-octoxy-5-phenylbenzene
CID 15176798
1-[[4-fluoro-2-(propoxymethyl)phenyl]methyl]-2-phenylhydrazine
CID 169385047
1-[(2,4-difluoro-6-methoxyphenyl)methyl]-2-phenylhydrazine
CID 169386210

Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine?
The IUPAC name of 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine (CID 169384804) is 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine is CCCCCCOc1c(F)cc(F)cc1CNNc1ccccc1.
What is the InChIKey of 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine?
The InChIKey is YVICOQFMPCONTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24F2N2O/c1-2-3-4-8-11-24-19-15(12-16(20)13-18(19)21)14-22-23-17-9-6-5-7-10-17/h5-7,9-10,12-13,22-23H,2-4,8,11,14H2,1H3.
What are the key properties of 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine?
1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine has a molecular weight of 334.41 g/mol, XLogP of 5.04, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine is sourced from PubChem (CID 169384804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).