[(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine

C14H16FN3O2 — CID 105258685

IUPAC[(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)c2ccncc2F)c1
InChIInChI=1S/C14H16FN3O2/c1-19-10-5-9(6-11(7-10)20-2)14(18-16)12-3-4-17-8-13(12)15/h3-8,14,18H,16H2,1-2H3
InChIKeyKHKAYRVRVTVDFV-UHFFFAOYSA-N
MW277.30 g/mol
LogP1.79
Rot. Bonds5

About [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine

[(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (PubChem CID 105258685) has the molecular formula C14H16FN3O2 and a molecular weight of 277.30 g/mol. Its IUPAC name is [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
PubChem CID105258685
Molecular FormulaC14H16FN3O2
Molecular Weight277.30 g/mol
Exact Mass277.12
IUPAC Name[(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)c2ccncc2F)c1
InChIInChI=1S/C14H16FN3O2/c1-19-10-5-9(6-11(7-10)20-2)14(18-16)12-3-4-17-8-13(12)15/h3-8,14,18H,16H2,1-2H3
InChIKeyKHKAYRVRVTVDFV-UHFFFAOYSA-N
XLogP1.79
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.30
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[(4-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105192724
[(3-bromo-5-methylphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105335328
[(3-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105193032
[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105335389
[(3-fluoro-4-pyridinyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105258630
[(3,5-dimethoxyphenyl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105329847
[(2,4-difluorophenyl)-(3-methoxy-4-pyridinyl)methyl]hydrazine
CID 105303259
[(3-ethyl-4-pyridinyl)-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105262324
[(3,5-dichlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 103397720
[(2-fluoro-3-methylphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105335451
[(2-chloro-5-fluorophenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105397937
[(4-chlorophenyl)-(3-methoxy-4-pyridinyl)methyl]hydrazine
CID 105281225

Frequently Asked Questions

What is the IUPAC name of [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (CID 105258685) is [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is COc1cc(OC)cc(C(NN)c2ccncc2F)c1.
What is the InChIKey of [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The InChIKey is KHKAYRVRVTVDFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O2/c1-19-10-5-9(6-11(7-10)20-2)14(18-16)12-3-4-17-8-13(12)15/h3-8,14,18H,16H2,1-2H3.
What are the key properties of [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
[(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine has a molecular weight of 277.30 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105258685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).