1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine

C12H25FN2O — CID 174002188

IUPAC1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine
SMILESCC/C=C(/F)CC(C)[C@@H](C)NNCCOC
InChIInChI=1S/C12H25FN2O/c1-5-6-12(13)9-10(2)11(3)15-14-7-8-16-4/h6,10-11,14-15H,5,7-9H2,1-4H3/b12-6+/t10?,11-/m1/s1
InChIKeyHKFPNEVIBYBRSE-BRWLHLSKSA-N
MW232.34 g/mol
LogP2.41
Rot. Bonds9

About 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine

1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine (PubChem CID 174002188) has the molecular formula C12H25FN2O and a molecular weight of 232.34 g/mol. Its IUPAC name is 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine.

Molecular Properties

Compound Name1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine
PubChem CID174002188
Molecular FormulaC12H25FN2O
Molecular Weight232.34 g/mol
Exact Mass232.20
IUPAC Name1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine
SMILESCC/C=C(/F)CC(C)[C@@H](C)NNCCOC
InChIInChI=1S/C12H25FN2O/c1-5-6-12(13)9-10(2)11(3)15-14-7-8-16-4/h6,10-11,14-15H,5,7-9H2,1-4H3/b12-6+/t10?,11-/m1/s1
InChIKeyHKFPNEVIBYBRSE-BRWLHLSKSA-N
XLogP2.41
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.34
LogP ≤ 52.41
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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Frequently Asked Questions

What is the IUPAC name of 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine?
The IUPAC name of 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine (CID 174002188) is 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine.
What is the SMILES notation for 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine?
The canonical SMILES for 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine is CC/C=C(/F)CC(C)[C@@H](C)NNCCOC.
What is the InChIKey of 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine?
The InChIKey is HKFPNEVIBYBRSE-BRWLHLSKSA-N. The full InChI is InChI=1S/C12H25FN2O/c1-5-6-12(13)9-10(2)11(3)15-14-7-8-16-4/h6,10-11,14-15H,5,7-9H2,1-4H3/b12-6+/t10?,11-/m1/s1.
What are the key properties of 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine?
1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine has a molecular weight of 232.34 g/mol, XLogP of 2.41, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E,2R)-5-fluoro-3-methyloct-5-en-2-yl]-2-(2-methoxyethyl)hydrazine is sourced from PubChem (CID 174002188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).