(6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane

C10H25N2O4P — CID 142553360

IUPAC(6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane
SMILESCC.CN(C)P(C)(=O)OC[C@@H]1CNCC(O)O1
InChIInChI=1S/C8H19N2O4P.C2H6/c1-10(2)15(3,12)13-6-7-4-9-5-8(11)14-7;1-2/h7-9,11H,4-6H2,1-3H3;1-2H3/t7-,8?,15?;/m0./s1
InChIKeyWMCRVHAIGGPJQS-NIFYMYHISA-N
MW268.29 g/mol
LogP0.72
Rot. Bonds4

About (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane

(6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane (PubChem CID 142553360) has the molecular formula C10H25N2O4P and a molecular weight of 268.29 g/mol. Its IUPAC name is (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane.

Molecular Properties

Compound Name(6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane
PubChem CID142553360
Molecular FormulaC10H25N2O4P
Molecular Weight268.29 g/mol
Exact Mass268.16
IUPAC Name(6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane
SMILESCC.CN(C)P(C)(=O)OC[C@@H]1CNCC(O)O1
InChIInChI=1S/C8H19N2O4P.C2H6/c1-10(2)15(3,12)13-6-7-4-9-5-8(11)14-7;1-2/h7-9,11H,4-6H2,1-3H3;1-2H3/t7-,8?,15?;/m0./s1
InChIKeyWMCRVHAIGGPJQS-NIFYMYHISA-N
XLogP0.72
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane?
The IUPAC name of (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane (CID 142553360) is (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane.
What is the SMILES notation for (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane?
The canonical SMILES for (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane is CC.CN(C)P(C)(=O)OC[C@@H]1CNCC(O)O1.
What is the InChIKey of (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane?
The InChIKey is WMCRVHAIGGPJQS-NIFYMYHISA-N. The full InChI is InChI=1S/C8H19N2O4P.C2H6/c1-10(2)15(3,12)13-6-7-4-9-5-8(11)14-7;1-2/h7-9,11H,4-6H2,1-3H3;1-2H3/t7-,8?,15?;/m0./s1.
What are the key properties of (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane?
(6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane has a molecular weight of 268.29 g/mol, XLogP of 0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-2-ol;ethane is sourced from PubChem (CID 142553360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).