[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine

C10H19ClN4O — CID 105271122

IUPAC[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
SMILESCCOC(CC)C(NN)c1c(Cl)cnn1C
InChIInChI=1S/C10H19ClN4O/c1-4-8(16-5-2)9(14-12)10-7(11)6-13-15(10)3/h6,8-9,14H,4-5,12H2,1-3H3
InChIKeyVTQHEWRUHUNMRN-UHFFFAOYSA-N
MW246.74 g/mol
LogP1.39
Rot. Bonds6

About [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine

[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine (PubChem CID 105271122) has the molecular formula C10H19ClN4O and a molecular weight of 246.74 g/mol. Its IUPAC name is [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
PubChem CID105271122
Molecular FormulaC10H19ClN4O
Molecular Weight246.74 g/mol
Exact Mass246.12
IUPAC Name[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
SMILESCCOC(CC)C(NN)c1c(Cl)cnn1C
InChIInChI=1S/C10H19ClN4O/c1-4-8(16-5-2)9(14-12)10-7(11)6-13-15(10)3/h6,8-9,14H,4-5,12H2,1-3H3
InChIKeyVTQHEWRUHUNMRN-UHFFFAOYSA-N
XLogP1.39
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 51.39
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'}

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Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The IUPAC name of [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine (CID 105271122) is [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine.
What is the SMILES notation for [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The canonical SMILES for [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine is CCOC(CC)C(NN)c1c(Cl)cnn1C.
What is the InChIKey of [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The InChIKey is VTQHEWRUHUNMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClN4O/c1-4-8(16-5-2)9(14-12)10-7(11)6-13-15(10)3/h6,8-9,14H,4-5,12H2,1-3H3.
What are the key properties of [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine has a molecular weight of 246.74 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine is sourced from PubChem (CID 105271122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).