sodium;hydride;3-prop-2-enoxymorpholin-2-ol

C7H14NNaO3 — CID 175272620

IUPACsodium;hydride;3-prop-2-enoxymorpholin-2-ol
SMILESC=CCOC1NCCOC1O.[H-].[Na+]
InChIInChI=1S/C7H13NO3.Na.H/c1-2-4-10-6-7(9)11-5-3-8-6;;/h2,6-9H,1,3-5H2;;/q;+1;-1
InChIKeyZTMMQAUZJZAAKH-UHFFFAOYSA-N
MW183.18 g/mol
LogP-3.43
Rot. Bonds3

About sodium;hydride;3-prop-2-enoxymorpholin-2-ol

sodium;hydride;3-prop-2-enoxymorpholin-2-ol (PubChem CID 175272620) has the molecular formula C7H14NNaO3 and a molecular weight of 183.18 g/mol. Its IUPAC name is sodium;hydride;3-prop-2-enoxymorpholin-2-ol.

Molecular Properties

Compound Namesodium;hydride;3-prop-2-enoxymorpholin-2-ol
PubChem CID175272620
Molecular FormulaC7H14NNaO3
Molecular Weight183.18 g/mol
Exact Mass183.09
IUPAC Namesodium;hydride;3-prop-2-enoxymorpholin-2-ol
SMILESC=CCOC1NCCOC1O.[H-].[Na+]
InChIInChI=1S/C7H13NO3.Na.H/c1-2-4-10-6-7(9)11-5-3-8-6;;/h2,6-9H,1,3-5H2;;/q;+1;-1
InChIKeyZTMMQAUZJZAAKH-UHFFFAOYSA-N
XLogP-3.43
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.18
LogP ≤ 5-3.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

CID 175756974
CID 175756974
3-Prop-2-enoxymorpholin-2-ol
CID 175272621

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;3-prop-2-enoxymorpholin-2-ol?
The IUPAC name of sodium;hydride;3-prop-2-enoxymorpholin-2-ol (CID 175272620) is sodium;hydride;3-prop-2-enoxymorpholin-2-ol.
What is the SMILES notation for sodium;hydride;3-prop-2-enoxymorpholin-2-ol?
The canonical SMILES for sodium;hydride;3-prop-2-enoxymorpholin-2-ol is C=CCOC1NCCOC1O.[H-].[Na+].
What is the InChIKey of sodium;hydride;3-prop-2-enoxymorpholin-2-ol?
The InChIKey is ZTMMQAUZJZAAKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3.Na.H/c1-2-4-10-6-7(9)11-5-3-8-6;;/h2,6-9H,1,3-5H2;;/q;+1;-1.
What are the key properties of sodium;hydride;3-prop-2-enoxymorpholin-2-ol?
sodium;hydride;3-prop-2-enoxymorpholin-2-ol has a molecular weight of 183.18 g/mol, XLogP of -3.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;3-prop-2-enoxymorpholin-2-ol is sourced from PubChem (CID 175272620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).