[(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine

C12H17FN2O — CID 105253466

IUPAC[(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine
SMILESCOc1ccc(F)cc1C(NN)C1(C)CC1
InChIInChI=1S/C12H17FN2O/c1-12(5-6-12)11(15-14)9-7-8(13)3-4-10(9)16-2/h3-4,7,11,15H,5-6,14H2,1-2H3
InChIKeyFXEXIOVEAJOIPA-UHFFFAOYSA-N
MW224.28 g/mol
LogP2.14
Rot. Bonds4

About [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine

[(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine (PubChem CID 105253466) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine
PubChem CID105253466
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name[(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine
SMILESCOc1ccc(F)cc1C(NN)C1(C)CC1
InChIInChI=1S/C12H17FN2O/c1-12(5-6-12)11(15-14)9-7-8(13)3-4-10(9)16-2/h3-4,7,11,15H,5-6,14H2,1-2H3
InChIKeyFXEXIOVEAJOIPA-UHFFFAOYSA-N
XLogP2.14
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine?
The IUPAC name of [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine (CID 105253466) is [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine.
What is the SMILES notation for [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine?
The canonical SMILES for [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine is COc1ccc(F)cc1C(NN)C1(C)CC1.
What is the InChIKey of [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine?
The InChIKey is FXEXIOVEAJOIPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-12(5-6-12)11(15-14)9-7-8(13)3-4-10(9)16-2/h3-4,7,11,15H,5-6,14H2,1-2H3.
What are the key properties of [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine?
[(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine has a molecular weight of 224.28 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine is sourced from PubChem (CID 105253466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).