4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine

C14H22NO3P — CID 101075914

IUPAC4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine
SMILESCC(C)(C)OP(=O)(c1ccccc1)N1CCOCC1
InChIInChI=1S/C14H22NO3P/c1-14(2,3)18-19(16,13-7-5-4-6-8-13)15-9-11-17-12-10-15/h4-8H,9-12H2,1-3H3
InChIKeyUIXRJXBWZVDYEH-UHFFFAOYSA-N
MW283.31 g/mol
LogP2.65
Rot. Bonds3

About 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine

4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine (PubChem CID 101075914) has the molecular formula C14H22NO3P and a molecular weight of 283.31 g/mol. Its IUPAC name is 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine.

Molecular Properties

Compound Name4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine
PubChem CID101075914
Molecular FormulaC14H22NO3P
Molecular Weight283.31 g/mol
Exact Mass283.13
IUPAC Name4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine
SMILESCC(C)(C)OP(=O)(c1ccccc1)N1CCOCC1
InChIInChI=1S/C14H22NO3P/c1-14(2,3)18-19(16,13-7-5-4-6-8-13)15-9-11-17-12-10-15/h4-8H,9-12H2,1-3H3
InChIKeyUIXRJXBWZVDYEH-UHFFFAOYSA-N
XLogP2.65
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

morpholin-4-yl-diphenyl-sulfanylidene-lambda5-phosphane
CID 10638162
4-(1-diphenylphosphorylbutyl)morpholine
CID 86180321
N-(2-chloroethyl)-N-[(2-methylpropan-2-yl)oxy-morpholin-4-ylphosphoryl]propan-1-amine
CID 58463751
N-dimorpholin-4-ylphosphoryl-4-methylaniline
CID 139064039
4-[[(2E)-2-benzylidenehydrazinyl]-morpholin-4-ylphosphoryl]morpholine
CID 13381631
4-diphenylphosphoryl-2,6-dimethylmorpholine
CID 10567336
lithium;diphenylphosphinate;oxolane
CID 139065490
1-[morpholin-4-yl(phenoxy)phosphoryl]-2-phenylhydrazine
CID 12574843
N-methyl-N-[morpholin-4-yl-[(triphenyl-lambda5-phosphanylidene)amino]phosphinothioyl]methanamine
CID 13381643
4-[(S)-(4-bromophenyl)-[morpholin-4-yl(phenyl)phosphoryl]methyl]morpholine
CID 29020981
1-(tert-butyl-morpholin-4-yl-phenyl-λ5-phosphanylidene)-3-(4-methoxyphenyl)thiourea
CID 23820411
1-(tert-butyl-morpholin-4-yl-phenyl-λ5-phosphanylidene)-3-(4-methylphenyl)thiourea
CID 4595013

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine?
The IUPAC name of 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine (CID 101075914) is 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine.
What is the SMILES notation for 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine?
The canonical SMILES for 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine is CC(C)(C)OP(=O)(c1ccccc1)N1CCOCC1.
What is the InChIKey of 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine?
The InChIKey is UIXRJXBWZVDYEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22NO3P/c1-14(2,3)18-19(16,13-7-5-4-6-8-13)15-9-11-17-12-10-15/h4-8H,9-12H2,1-3H3.
What are the key properties of 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine?
4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine has a molecular weight of 283.31 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine is sourced from PubChem (CID 101075914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).