[6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol

C18H37N4O7P — CID 163754208

IUPAC[6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol
SMILESCC1CNCC(COP(N)(=O)N2CC(C)OC(COCC3CNCC(CO)O3)C2)O1
InChIInChI=1S/C18H37N4O7P/c1-13-3-20-6-17(27-13)12-26-30(19,24)22-7-14(2)28-18(8-22)11-25-10-16-5-21-4-15(9-23)29-16/h13-18,20-21,23H,3-12H2,1-2H3,(H2,19,24)
InChIKeyLSPQGWRLDCBEJK-UHFFFAOYSA-N
MW452.49 g/mol
LogP-1.10
Rot. Bonds9

About [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol

[6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol (PubChem CID 163754208) has the molecular formula C18H37N4O7P and a molecular weight of 452.49 g/mol. Its IUPAC name is [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol
PubChem CID163754208
Molecular FormulaC18H37N4O7P
Molecular Weight452.49 g/mol
Exact Mass452.24
IUPAC Name[6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol
SMILESCC1CNCC(COP(N)(=O)N2CC(C)OC(COCC3CNCC(CO)O3)C2)O1
InChIInChI=1S/C18H37N4O7P/c1-13-3-20-6-17(27-13)12-26-30(19,24)22-7-14(2)28-18(8-22)11-25-10-16-5-21-4-15(9-23)29-16/h13-18,20-21,23H,3-12H2,1-2H3,(H2,19,24)
InChIKeyLSPQGWRLDCBEJK-UHFFFAOYSA-N
XLogP-1.10
TPSA136.77 Ų
H-Bond Donors4
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.49
LogP ≤ 5-1.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol?
The IUPAC name of [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol (CID 163754208) is [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol.
What is the SMILES notation for [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol?
The canonical SMILES for [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol is CC1CNCC(COP(N)(=O)N2CC(C)OC(COCC3CNCC(CO)O3)C2)O1.
What is the InChIKey of [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol?
The InChIKey is LSPQGWRLDCBEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N4O7P/c1-13-3-20-6-17(27-13)12-26-30(19,24)22-7-14(2)28-18(8-22)11-25-10-16-5-21-4-15(9-23)29-16/h13-18,20-21,23H,3-12H2,1-2H3,(H2,19,24).
What are the key properties of [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol?
[6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol has a molecular weight of 452.49 g/mol, XLogP of -1.10, 9 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[[4-[amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methoxymethyl]morpholin-2-yl]methanol is sourced from PubChem (CID 163754208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).