[1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine

C11H15ClF2N2O — CID 103151942

IUPAC[1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)F)c1cccc(Cl)c1
InChIInChI=1S/C11H15ClF2N2O/c12-9-3-1-2-8(6-9)10(16-15)4-5-17-7-11(13)14/h1-3,6,10-11,16H,4-5,7,15H2
InChIKeyISGDSOPVCYYNPZ-UHFFFAOYSA-N
MW264.70 g/mol
LogP2.52
Rot. Bonds7

About [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine

[1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine (PubChem CID 103151942) has the molecular formula C11H15ClF2N2O and a molecular weight of 264.70 g/mol. Its IUPAC name is [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine
PubChem CID103151942
Molecular FormulaC11H15ClF2N2O
Molecular Weight264.70 g/mol
Exact Mass264.08
IUPAC Name[1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)F)c1cccc(Cl)c1
InChIInChI=1S/C11H15ClF2N2O/c12-9-3-1-2-8(6-9)10(16-15)4-5-17-7-11(13)14/h1-3,6,10-11,16H,4-5,7,15H2
InChIKeyISGDSOPVCYYNPZ-UHFFFAOYSA-N
XLogP2.52
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.70
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[3-(2,2-difluoroethoxy)-1-(3-fluorophenyl)propyl]hydrazine
CID 103151788
[3-(2,2-difluoroethoxy)-1-(3-propan-2-yloxyphenyl)propyl]hydrazine
CID 103151840
[1-(2-chloro-5-fluorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 103152085
[1-(3-chlorophenyl)-3-methylsulfanylpropyl]hydrazine
CID 105289207
[3-(2,2-difluoroethoxy)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]hydrazine
CID 103151989
[3-(2,2-difluoroethoxy)-1-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydrazine
CID 103151844
[3-(2,2-difluoroethoxy)-1-(5-methyl-3-pyridinyl)propyl]hydrazine
CID 103151752
[1-(2,6-dichlorophenyl)-4-(2,2-difluoroethoxy)butan-2-yl]hydrazine
CID 103152068
3-(2,2-difluoroethoxy)-N-methyl-1-(3-propan-2-yloxyphenyl)propan-1-amine
CID 103149327
[1-(4-cyclopropyloxyphenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 103151965
[1-(3-chlorophenyl)-3-methoxybutyl]hydrazine
CID 105267204
[1-(3-methylphenyl)-3-propoxypropyl]hydrazine
CID 105284873

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine (CID 103151942) is [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine is NNC(CCOCC(F)F)c1cccc(Cl)c1.
What is the InChIKey of [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine?
The InChIKey is ISGDSOPVCYYNPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClF2N2O/c12-9-3-1-2-8(6-9)10(16-15)4-5-17-7-11(13)14/h1-3,6,10-11,16H,4-5,7,15H2.
What are the key properties of [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine?
[1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine has a molecular weight of 264.70 g/mol, XLogP of 2.52, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chlorophenyl)-3-(2,2-difluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103151942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).