3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione

C14H23N3O4 — CID 8002972

IUPAC3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
SMILESO=C1NC2(CCCC2)C(=O)N1C[C@H](O)CN1CCOCC1
InChIInChI=1S/C14H23N3O4/c18-11(9-16-5-7-21-8-6-16)10-17-12(19)14(15-13(17)20)3-1-2-4-14/h11,18H,1-10H2,(H,15,20)/t11-/m1/s1
InChIKeyHZKUICBXGVKRPH-LLVKDONJSA-N
MW297.36 g/mol
LogP-0.46
Rot. Bonds4

About 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione

3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione (PubChem CID 8002972) has the molecular formula C14H23N3O4 and a molecular weight of 297.36 g/mol. Its IUPAC name is 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione.

Molecular Properties

Compound Name3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
PubChem CID8002972
Molecular FormulaC14H23N3O4
Molecular Weight297.36 g/mol
Exact Mass297.17
IUPAC Name3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
SMILESO=C1NC2(CCCC2)C(=O)N1C[C@H](O)CN1CCOCC1
InChIInChI=1S/C14H23N3O4/c18-11(9-16-5-7-21-8-6-16)10-17-12(19)14(15-13(17)20)3-1-2-4-14/h11,18H,1-10H2,(H,15,20)/t11-/m1/s1
InChIKeyHZKUICBXGVKRPH-LLVKDONJSA-N
XLogP-0.46
TPSA82.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione?
The IUPAC name of 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione (CID 8002972) is 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione.
What is the SMILES notation for 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione?
The canonical SMILES for 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione is O=C1NC2(CCCC2)C(=O)N1C[C@H](O)CN1CCOCC1.
What is the InChIKey of 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione?
The InChIKey is HZKUICBXGVKRPH-LLVKDONJSA-N. The full InChI is InChI=1S/C14H23N3O4/c18-11(9-16-5-7-21-8-6-16)10-17-12(19)14(15-13(17)20)3-1-2-4-14/h11,18H,1-10H2,(H,15,20)/t11-/m1/s1.
What are the key properties of 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione?
3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione has a molecular weight of 297.36 g/mol, XLogP of -0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-1,3-diazaspiro[4.4]nonane-2,4-dione is sourced from PubChem (CID 8002972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).