[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine

C15H18FN3O — CID 105258537

IUPAC[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine
SMILESCOc1ccc(CCC(NN)c2ccncc2F)cc1
InChIInChI=1S/C15H18FN3O/c1-20-12-5-2-11(3-6-12)4-7-15(19-17)13-8-9-18-10-14(13)16/h2-3,5-6,8-10,15,19H,4,7,17H2,1H3
InChIKeySJZBEVAZUDLPSV-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.37
Rot. Bonds6

About [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine

[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine (PubChem CID 105258537) has the molecular formula C15H18FN3O and a molecular weight of 275.33 g/mol. Its IUPAC name is [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine
PubChem CID105258537
Molecular FormulaC15H18FN3O
Molecular Weight275.33 g/mol
Exact Mass275.14
IUPAC Name[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine
SMILESCOc1ccc(CCC(NN)c2ccncc2F)cc1
InChIInChI=1S/C15H18FN3O/c1-20-12-5-2-11(3-6-12)4-7-15(19-17)13-8-9-18-10-14(13)16/h2-3,5-6,8-10,15,19H,4,7,17H2,1H3
InChIKeySJZBEVAZUDLPSV-UHFFFAOYSA-N
XLogP2.37
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine?
The IUPAC name of [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine (CID 105258537) is [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine.
What is the SMILES notation for [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine?
The canonical SMILES for [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine is COc1ccc(CCC(NN)c2ccncc2F)cc1.
What is the InChIKey of [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine?
The InChIKey is SJZBEVAZUDLPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O/c1-20-12-5-2-11(3-6-12)4-7-15(19-17)13-8-9-18-10-14(13)16/h2-3,5-6,8-10,15,19H,4,7,17H2,1H3.
What are the key properties of [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine?
[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine has a molecular weight of 275.33 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine is sourced from PubChem (CID 105258537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).