[4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine

C13H29N3O2 — CID 105247779

IUPAC[4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine
SMILESCCCN1CCOC(C(NN)C(C)CCOC)C1
InChIInChI=1S/C13H29N3O2/c1-4-6-16-7-9-18-12(10-16)13(15-14)11(2)5-8-17-3/h11-13,15H,4-10,14H2,1-3H3
InChIKeyHJYSSZXTRGIADF-UHFFFAOYSA-N
MW259.39 g/mol
LogP0.60
Rot. Bonds8

About [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine

[4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine (PubChem CID 105247779) has the molecular formula C13H29N3O2 and a molecular weight of 259.39 g/mol. Its IUPAC name is [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine.

Molecular Properties

Compound Name[4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine
PubChem CID105247779
Molecular FormulaC13H29N3O2
Molecular Weight259.39 g/mol
Exact Mass259.23
IUPAC Name[4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine
SMILESCCCN1CCOC(C(NN)C(C)CCOC)C1
InChIInChI=1S/C13H29N3O2/c1-4-6-16-7-9-18-12(10-16)13(15-14)11(2)5-8-17-3/h11-13,15H,4-10,14H2,1-3H3
InChIKeyHJYSSZXTRGIADF-UHFFFAOYSA-N
XLogP0.60
TPSA59.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 50.60
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 [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine?
The IUPAC name of [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine (CID 105247779) is [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine.
What is the SMILES notation for [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine?
The canonical SMILES for [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine is CCCN1CCOC(C(NN)C(C)CCOC)C1.
What is the InChIKey of [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine?
The InChIKey is HJYSSZXTRGIADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O2/c1-4-6-16-7-9-18-12(10-16)13(15-14)11(2)5-8-17-3/h11-13,15H,4-10,14H2,1-3H3.
What are the key properties of [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine?
[4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine has a molecular weight of 259.39 g/mol, XLogP of 0.60, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-2-methyl-1-(4-propylmorpholin-2-yl)butyl]hydrazine is sourced from PubChem (CID 105247779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).