(2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine

C11H23N3O6P2 — CID 146355784

IUPAC(2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine
SMILESC[C@H]1CNC[C@@H](COP(N)(=O)N2CCO[C@H](COP=O)C2)O1
InChIInChI=1S/C11H23N3O6P2/c1-9-4-13-5-10(20-9)8-19-22(12,16)14-2-3-17-11(6-14)7-18-21-15/h9-11,13H,2-8H2,1H3,(H2,12,16)/t9-,10-,11-,22?/m0/s1
InChIKeyCCSFNRISVPRZKW-GMWNMMDESA-N
MW355.27 g/mol
LogP0.37
Rot. Bonds7

About (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine

(2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine (PubChem CID 146355784) has the molecular formula C11H23N3O6P2 and a molecular weight of 355.27 g/mol. Its IUPAC name is (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine.

Molecular Properties

Compound Name(2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine
PubChem CID146355784
Molecular FormulaC11H23N3O6P2
Molecular Weight355.27 g/mol
Exact Mass355.11
IUPAC Name(2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine
SMILESC[C@H]1CNC[C@@H](COP(N)(=O)N2CCO[C@H](COP=O)C2)O1
InChIInChI=1S/C11H23N3O6P2/c1-9-4-13-5-10(20-9)8-19-22(12,16)14-2-3-17-11(6-14)7-18-21-15/h9-11,13H,2-8H2,1H3,(H2,12,16)/t9-,10-,11-,22?/m0/s1
InChIKeyCCSFNRISVPRZKW-GMWNMMDESA-N
XLogP0.37
TPSA112.35 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.27
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine with MolForge

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Related Compounds

2-[[(2-Ethyl-6-methylmorpholin-4-yl)-methylphosphoryl]oxymethyl]-4,6-dimethylmorpholine
CID 21040814
CID 21063286
CID 21063286
CID 22088440
CID 22088440
[4-[Amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methanol
CID 22969304
N-[(4,6-dimethylmorpholin-2-yl)methoxy-[2-(methoxymethyl)-6-methylmorpholin-4-yl]phosphoryl]-N-methylmethanamine
CID 59042019
CID 88530029
CID 88530029
CID 89223022
CID 89223022
N-[[2-[[dimethylamino-[2-(methoxymethyl)-6-methylmorpholin-4-yl]phosphoryl]oxymethyl]-6-methylmorpholin-4-yl]-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-N-methylmethanamine
CID 89792729
N-methyl-N-[methyl-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]methanamine
CID 117683329
CID 123518368
CID 123518368
CID 124023726
CID 124023726
dimethylamino-[[(2S)-4-[2-[dimethylamino-[[(2S)-morpholin-2-yl]methoxy]phosphoryl]ethyl]morpholin-2-yl]methoxy]-oxophosphanium
CID 134442399

Frequently Asked Questions

What is the IUPAC name of (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine?
The IUPAC name of (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine (CID 146355784) is (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine.
What is the SMILES notation for (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine?
The canonical SMILES for (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine is C[C@H]1CNC[C@@H](COP(N)(=O)N2CCO[C@H](COP=O)C2)O1.
What is the InChIKey of (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine?
The InChIKey is CCSFNRISVPRZKW-GMWNMMDESA-N. The full InChI is InChI=1S/C11H23N3O6P2/c1-9-4-13-5-10(20-9)8-19-22(12,16)14-2-3-17-11(6-14)7-18-21-15/h9-11,13H,2-8H2,1H3,(H2,12,16)/t9-,10-,11-,22?/m0/s1.
What are the key properties of (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine?
(2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine has a molecular weight of 355.27 g/mol, XLogP of 0.37, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-[amino-[[(2S,6S)-6-methylmorpholin-2-yl]methoxy]phosphoryl]-2-(phosphorosooxymethyl)morpholine is sourced from PubChem (CID 146355784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).