[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine

C12H14F2N2O — CID 102649888

IUPAC[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
SMILESNNC(C1=CCCCO1)c1ccc(F)c(F)c1
InChIInChI=1S/C12H14F2N2O/c13-9-5-4-8(7-10(9)14)12(16-15)11-3-1-2-6-17-11/h3-5,7,12,16H,1-2,6,15H2
InChIKeyMQVLAHLOFTVVPQ-UHFFFAOYSA-N
MW240.25 g/mol
LogP2.16
Rot. Bonds3

About [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine

[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine (PubChem CID 102649888) has the molecular formula C12H14F2N2O and a molecular weight of 240.25 g/mol. Its IUPAC name is [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
PubChem CID102649888
Molecular FormulaC12H14F2N2O
Molecular Weight240.25 g/mol
Exact Mass240.11
IUPAC Name[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
SMILESNNC(C1=CCCCO1)c1ccc(F)c(F)c1
InChIInChI=1S/C12H14F2N2O/c13-9-5-4-8(7-10(9)14)12(16-15)11-3-1-2-6-17-11/h3-5,7,12,16H,1-2,6,15H2
InChIKeyMQVLAHLOFTVVPQ-UHFFFAOYSA-N
XLogP2.16
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.25
LogP ≤ 52.16
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

[3,4-dihydro-2H-pyran-6-yl-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 102649912
(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647123
[(3-chloro-4-fluorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654140
[(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102649953
[3,4-dihydro-2H-pyran-6-yl-(3-ethoxyphenyl)methyl]hydrazine
CID 102649871
(4-bromo-3-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102648870
N-[3,4-dihydro-2H-pyran-6-yl-(3-fluoro-4-methoxyphenyl)methyl]propan-1-amine
CID 102649591
[(3,4-difluorophenyl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208117
[(4-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105193316
[(2,6-dichlorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102650276
[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654296
[(S)-(3,4-difluorophenyl)-phenylmethyl]hydrazine
CID 124596469

Frequently Asked Questions

What is the IUPAC name of [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The IUPAC name of [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine (CID 102649888) is [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine.
What is the SMILES notation for [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The canonical SMILES for [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine is NNC(C1=CCCCO1)c1ccc(F)c(F)c1.
What is the InChIKey of [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The InChIKey is MQVLAHLOFTVVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F2N2O/c13-9-5-4-8(7-10(9)14)12(16-15)11-3-1-2-6-17-11/h3-5,7,12,16H,1-2,6,15H2.
What are the key properties of [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine has a molecular weight of 240.25 g/mol, XLogP of 2.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine is sourced from PubChem (CID 102649888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).