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

C12H14ClFN2O — CID 102649953

IUPAC[(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
SMILESNNC(C1=CCCCO1)c1ccc(F)cc1Cl
InChIInChI=1S/C12H14ClFN2O/c13-10-7-8(14)4-5-9(10)12(16-15)11-3-1-2-6-17-11/h3-5,7,12,16H,1-2,6,15H2
InChIKeyDHFHZUUADWFRIE-UHFFFAOYSA-N
MW256.71 g/mol
LogP2.68
Rot. Bonds3

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

[(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine (PubChem CID 102649953) has the molecular formula C12H14ClFN2O and a molecular weight of 256.71 g/mol. Its IUPAC name is [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
PubChem CID102649953
Molecular FormulaC12H14ClFN2O
Molecular Weight256.71 g/mol
Exact Mass256.08
IUPAC Name[(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
SMILESNNC(C1=CCCCO1)c1ccc(F)cc1Cl
InChIInChI=1S/C12H14ClFN2O/c13-10-7-8(14)4-5-9(10)12(16-15)11-3-1-2-6-17-11/h3-5,7,12,16H,1-2,6,15H2
InChIKeyDHFHZUUADWFRIE-UHFFFAOYSA-N
XLogP2.68
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.71
LogP ≤ 52.68
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

1-(2-chloro-4-fluorophenyl)-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
CID 102647382
N-[(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]propan-1-amine
CID 102647383
[(2,6-dichlorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102650276
[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102649888
1-(3,4-dihydro-2H-pyran-6-yl)-1-(4-fluoro-2-iodophenyl)-N-methylmethanamine
CID 114030282
[(3-chloro-2-pyridinyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 103445843
[1-benzothiophen-3-yl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102650251
[3,4-dihydro-2H-pyran-6-yl-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 102649912
[(3-chloro-4-fluorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654140
[2-(2,4-difluorophenyl)-1-(3,4-dihydro-2H-pyran-6-yl)ethyl]hydrazine
CID 102649984
(2,5-dichlorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102648980
(2-chlorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647320

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The IUPAC name of [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine (CID 102649953) is [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine.
What is the SMILES notation for [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The canonical SMILES for [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine is NNC(C1=CCCCO1)c1ccc(F)cc1Cl.
What is the InChIKey of [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The InChIKey is DHFHZUUADWFRIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClFN2O/c13-10-7-8(14)4-5-9(10)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 [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
[(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine has a molecular weight of 256.71 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-4-fluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine is sourced from PubChem (CID 102649953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).