[1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine

C14H27N5O — CID 105240069

IUPAC[1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine
SMILESCCn1cc(CC(NN)C(C)(C)N2CCOCC2)cn1
InChIInChI=1S/C14H27N5O/c1-4-19-11-12(10-16-19)9-13(17-15)14(2,3)18-5-7-20-8-6-18/h10-11,13,17H,4-9,15H2,1-3H3
InChIKeyHVSPTCLJEYPSQX-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.39
Rot. Bonds6

About [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine

[1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine (PubChem CID 105240069) has the molecular formula C14H27N5O and a molecular weight of 281.40 g/mol. Its IUPAC name is [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine
PubChem CID105240069
Molecular FormulaC14H27N5O
Molecular Weight281.40 g/mol
Exact Mass281.22
IUPAC Name[1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine
SMILESCCn1cc(CC(NN)C(C)(C)N2CCOCC2)cn1
InChIInChI=1S/C14H27N5O/c1-4-19-11-12(10-16-19)9-13(17-15)14(2,3)18-5-7-20-8-6-18/h10-11,13,17H,4-9,15H2,1-3H3
InChIKeyHVSPTCLJEYPSQX-UHFFFAOYSA-N
XLogP0.39
TPSA68.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine?
The IUPAC name of [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine (CID 105240069) is [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine.
What is the SMILES notation for [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine?
The canonical SMILES for [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine is CCn1cc(CC(NN)C(C)(C)N2CCOCC2)cn1.
What is the InChIKey of [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine?
The InChIKey is HVSPTCLJEYPSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5O/c1-4-19-11-12(10-16-19)9-13(17-15)14(2,3)18-5-7-20-8-6-18/h10-11,13,17H,4-9,15H2,1-3H3.
What are the key properties of [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine?
[1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine has a molecular weight of 281.40 g/mol, XLogP of 0.39, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-ethylpyrazol-4-yl)-3-methyl-3-morpholin-4-ylbutan-2-yl]hydrazine is sourced from PubChem (CID 105240069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).