1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol

C11H24N2O3 — CID 82724312

IUPAC1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol
SMILESCC(C)(C)ONCC(O)CN1CCOCC1
InChIInChI=1S/C11H24N2O3/c1-11(2,3)16-12-8-10(14)9-13-4-6-15-7-5-13/h10,12,14H,4-9H2,1-3H3
InChIKeyMBKRKEBHNGCCGQ-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.00
Rot. Bonds5

About 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol

1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol (PubChem CID 82724312) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol
PubChem CID82724312
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol
SMILESCC(C)(C)ONCC(O)CN1CCOCC1
InChIInChI=1S/C11H24N2O3/c1-11(2,3)16-12-8-10(14)9-13-4-6-15-7-5-13/h10,12,14H,4-9H2,1-3H3
InChIKeyMBKRKEBHNGCCGQ-UHFFFAOYSA-N
XLogP-0.00
TPSA53.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol (CID 82724312) is 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol is CC(C)(C)ONCC(O)CN1CCOCC1.
What is the InChIKey of 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is MBKRKEBHNGCCGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-11(2,3)16-12-8-10(14)9-13-4-6-15-7-5-13/h10,12,14H,4-9H2,1-3H3.
What are the key properties of 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol?
1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 232.32 g/mol, XLogP of -0.00, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylpropan-2-yl)oxyamino]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 82724312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).