[(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine

C12H12F2N2O — CID 105269045

IUPAC[(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine
SMILESCc1occc1C(NN)c1ccc(F)c(F)c1
InChIInChI=1S/C12H12F2N2O/c1-7-9(4-5-17-7)12(16-15)8-2-3-10(13)11(14)6-8/h2-6,12,16H,15H2,1H3
InChIKeyYWJLQCZXSCJKIP-UHFFFAOYSA-N
MW238.24 g/mol
LogP2.42
Rot. Bonds3

About [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine

[(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine (PubChem CID 105269045) has the molecular formula C12H12F2N2O and a molecular weight of 238.24 g/mol. Its IUPAC name is [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine
PubChem CID105269045
Molecular FormulaC12H12F2N2O
Molecular Weight238.24 g/mol
Exact Mass238.09
IUPAC Name[(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine
SMILESCc1occc1C(NN)c1ccc(F)c(F)c1
InChIInChI=1S/C12H12F2N2O/c1-7-9(4-5-17-7)12(16-15)8-2-3-10(13)11(14)6-8/h2-6,12,16H,15H2,1H3
InChIKeyYWJLQCZXSCJKIP-UHFFFAOYSA-N
XLogP2.42
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 52.42
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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Related Compounds

[(2-fluoro-4,6-dimethylphenyl)-(2-methylfuran-3-yl)methyl]hydrazine
CID 106884428
N-[(3-fluoro-4-methylphenyl)-(2-methylfuran-3-yl)methyl]ethanamine
CID 107129150
[(S)-(3,4-difluorophenyl)-phenylmethyl]hydrazine
CID 124596469
[(2-methylfuran-3-yl)-(4-propylphenyl)methyl]hydrazine
CID 105268936
[(2-methylfuran-3-yl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105269139
[(3,4-difluorophenyl)-(2-methyl-4-pyridinyl)methyl]hydrazine
CID 106756542
[(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine
CID 105269064
[(3,4-difluorophenyl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208117
[(4-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105193316
[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine
CID 105269294
[(2-chlorofuran-3-yl)-[3-fluoro-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107292531
[(3,4-difluorophenyl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105197212

Frequently Asked Questions

What is the IUPAC name of [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine?
The IUPAC name of [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine (CID 105269045) is [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine.
What is the SMILES notation for [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine?
The canonical SMILES for [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine is Cc1occc1C(NN)c1ccc(F)c(F)c1.
What is the InChIKey of [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine?
The InChIKey is YWJLQCZXSCJKIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2O/c1-7-9(4-5-17-7)12(16-15)8-2-3-10(13)11(14)6-8/h2-6,12,16H,15H2,1H3.
What are the key properties of [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine?
[(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine has a molecular weight of 238.24 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-difluorophenyl)-(2-methylfuran-3-yl)methyl]hydrazine is sourced from PubChem (CID 105269045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).