1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine

C19H25FN2O — CID 169384787

IUPAC1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine
SMILESCCCCCCOc1cc(CNNc2ccccc2)ccc1F
InChIInChI=1S/C19H25FN2O/c1-2-3-4-8-13-23-19-14-16(11-12-18(19)20)15-21-22-17-9-6-5-7-10-17/h5-7,9-12,14,21-22H,2-4,8,13,15H2,1H3
InChIKeyKLYOZEADHIWKSE-UHFFFAOYSA-N
MW316.42 g/mol
LogP4.90
Rot. Bonds10

About 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine

1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine (PubChem CID 169384787) has the molecular formula C19H25FN2O and a molecular weight of 316.42 g/mol. Its IUPAC name is 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine
PubChem CID169384787
Molecular FormulaC19H25FN2O
Molecular Weight316.42 g/mol
Exact Mass316.20
IUPAC Name1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine
SMILESCCCCCCOc1cc(CNNc2ccccc2)ccc1F
InChIInChI=1S/C19H25FN2O/c1-2-3-4-8-13-23-19-14-16(11-12-18(19)20)15-21-22-17-9-6-5-7-10-17/h5-7,9-12,14,21-22H,2-4,8,13,15H2,1H3
InChIKeyKLYOZEADHIWKSE-UHFFFAOYSA-N
XLogP4.90
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.42
LogP ≤ 54.90
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-[(3,4-difluoro-5-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384801
1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384784
1-[(3-chloro-4-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384780
1-[(3,5-difluoro-2-hexoxyphenyl)methyl]-2-phenylhydrazine
CID 169384804
1-[[3-(methoxymethyl)-4-propoxyphenyl]methyl]-2-phenylhydrazine
CID 169386185
1-[(3,5-difluoro-4-propoxyphenyl)methyl]-2-phenylhydrazine
CID 169384890
1-[(5-methyl-2-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384807
1-[(4-butoxy-2,6-difluorophenyl)methyl]-2-phenylhydrazine
CID 169385920
1,4-difluoro-2-hexoxybenzene
CID 23437312
1-[(5-chloro-2-propoxyphenyl)methyl]-2-phenylhydrazine
CID 169384738
1-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-phenylhydrazine
CID 169384519
1-[(4-chlorophenyl)methyl]-2-phenylhydrazine
CID 70410939

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine?
The IUPAC name of 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine (CID 169384787) is 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine is CCCCCCOc1cc(CNNc2ccccc2)ccc1F.
What is the InChIKey of 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine?
The InChIKey is KLYOZEADHIWKSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN2O/c1-2-3-4-8-13-23-19-14-16(11-12-18(19)20)15-21-22-17-9-6-5-7-10-17/h5-7,9-12,14,21-22H,2-4,8,13,15H2,1H3.
What are the key properties of 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine?
1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine has a molecular weight of 316.42 g/mol, XLogP of 4.90, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine is sourced from PubChem (CID 169384787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).