[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine

C11H17ClF4N4O — CID 103477685

IUPAC[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
SMILESCc1nn(C)c(Cl)c1CC(COCC(F)(F)C(F)F)NN
InChIInChI=1S/C11H17ClF4N4O/c1-6-8(9(12)20(2)19-6)3-7(18-17)4-21-5-11(15,16)10(13)14/h7,10,18H,3-5,17H2,1-2H3
InChIKeyXEJVYXIJHAFQPT-UHFFFAOYSA-N
MW332.73 g/mol
LogP1.67
Rot. Bonds8

About [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine

[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine (PubChem CID 103477685) has the molecular formula C11H17ClF4N4O and a molecular weight of 332.73 g/mol. Its IUPAC name is [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
PubChem CID103477685
Molecular FormulaC11H17ClF4N4O
Molecular Weight332.73 g/mol
Exact Mass332.10
IUPAC Name[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
SMILESCc1nn(C)c(Cl)c1CC(COCC(F)(F)C(F)F)NN
InChIInChI=1S/C11H17ClF4N4O/c1-6-8(9(12)20(2)19-6)3-7(18-17)4-21-5-11(15,16)10(13)14/h7,10,18H,3-5,17H2,1-2H3
InChIKeyXEJVYXIJHAFQPT-UHFFFAOYSA-N
XLogP1.67
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.73
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

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[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-5-methoxypentan-2-yl]hydrazine
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[1-(2-chloro-6-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
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[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(3-chloro-2-fluorophenyl)propan-2-yl]hydrazine
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1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2-methoxyethoxy)-N-methylpropan-2-amine
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[1-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
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3-(5-chloro-1,3-dimethylpyrazol-4-yl)-1,1-difluoropropan-2-amine
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Frequently Asked Questions

What is the IUPAC name of [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
The IUPAC name of [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine (CID 103477685) is [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
The canonical SMILES for [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine is Cc1nn(C)c(Cl)c1CC(COCC(F)(F)C(F)F)NN.
What is the InChIKey of [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
The InChIKey is XEJVYXIJHAFQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClF4N4O/c1-6-8(9(12)20(2)19-6)3-7(18-17)4-21-5-11(15,16)10(13)14/h7,10,18H,3-5,17H2,1-2H3.
What are the key properties of [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine has a molecular weight of 332.73 g/mol, XLogP of 1.67, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine is sourced from PubChem (CID 103477685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).