[(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine

C16H16FN3O — CID 105266541

IUPAC[(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
SMILESCc1cnc(C(NN)c2cc3cccc(F)c3o2)c(C)c1
InChIInChI=1S/C16H16FN3O/c1-9-6-10(2)14(19-8-9)15(20-18)13-7-11-4-3-5-12(17)16(11)21-13/h3-8,15,20H,18H2,1-2H3
InChIKeyHPHGBHXSWPUUQS-UHFFFAOYSA-N
MW285.32 g/mol
LogP3.14
Rot. Bonds3

About [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine

[(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine (PubChem CID 105266541) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
PubChem CID105266541
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC Name[(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
SMILESCc1cnc(C(NN)c2cc3cccc(F)c3o2)c(C)c1
InChIInChI=1S/C16H16FN3O/c1-9-6-10(2)14(19-8-9)15(20-18)13-7-11-4-3-5-12(17)16(11)21-13/h3-8,15,20H,18H2,1-2H3
InChIKeyHPHGBHXSWPUUQS-UHFFFAOYSA-N
XLogP3.14
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 53.14
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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Related Compounds

[(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine
CID 105200864
[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105258723
[(7-fluoro-1-benzofuran-2-yl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190989
[(3,5-dichloro-2-pyridinyl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105248604
[(7-fluoro-1-benzofuran-2-yl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230636
[(3,4-dichlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105257216
[(3-ethyl-4-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105262308
[(3,5-dichlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105339255
[(3,5-dimethyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105266432
1-(7-fluoro-1-benzofuran-2-yl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 114728621
[(3-bromo-5-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105238779
[(3-ethyl-1-methylpyrazol-4-yl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 102813247

Frequently Asked Questions

What is the IUPAC name of [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
The IUPAC name of [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine (CID 105266541) is [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine is Cc1cnc(C(NN)c2cc3cccc(F)c3o2)c(C)c1.
What is the InChIKey of [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
The InChIKey is HPHGBHXSWPUUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c1-9-6-10(2)14(19-8-9)15(20-18)13-7-11-4-3-5-12(17)16(11)21-13/h3-8,15,20H,18H2,1-2H3.
What are the key properties of [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine?
[(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine has a molecular weight of 285.32 g/mol, XLogP of 3.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105266541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).