4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine

C11H24NO3P — CID 163490188

IUPAC4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine
SMILESCOP(=O)(N1CCOCC1)C(C)(C)C(C)C
InChIInChI=1S/C11H24NO3P/c1-10(2)11(3,4)16(13,14-5)12-6-8-15-9-7-12/h10H,6-9H2,1-5H3
InChIKeyCLYBFIPZDIDIAC-UHFFFAOYSA-N
MW249.29 g/mol
LogP2.59
Rot. Bonds4

About 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine

4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine (PubChem CID 163490188) has the molecular formula C11H24NO3P and a molecular weight of 249.29 g/mol. Its IUPAC name is 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine.

Molecular Properties

Compound Name4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine
PubChem CID163490188
Molecular FormulaC11H24NO3P
Molecular Weight249.29 g/mol
Exact Mass249.15
IUPAC Name4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine
SMILESCOP(=O)(N1CCOCC1)C(C)(C)C(C)C
InChIInChI=1S/C11H24NO3P/c1-10(2)11(3,4)16(13,14-5)12-6-8-15-9-7-12/h10H,6-9H2,1-5H3
InChIKeyCLYBFIPZDIDIAC-UHFFFAOYSA-N
XLogP2.59
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.29
LogP ≤ 52.59
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

N-[chloro(morpholin-4-yl)phosphoryl]propan-2-amine
CID 13381598
dimorpholin-4-ylphosphinic acid
CID 4193589
2-chloro-N-(2-chloroethyl)-N-[methoxy(morpholin-4-yl)phosphoryl]ethanamine
CID 143387206
methyl (2R)-2-morpholin-4-ylpropanoate
CID 30030777
2,2,3-trimethyl-1-morpholin-4-ylbutan-1-one
CID 23551857
4-[3-methyl-5-[(2-methylpropan-2-yl)oxy]hexa-1,5-dienyl]sulfonylmorpholine
CID 91364609
4-[(2-methylpropan-2-yl)oxy-phenylphosphoryl]morpholine
CID 101075914
4-[(4-methoxyphenoxy)-morpholin-4-ylphosphoryl]morpholine
CID 3693433
methoxy-morpholin-4-yl-propan-2-ylphosphane
CID 171807486
4-(2,4-dimethylpentan-2-yl)morpholine
CID 67965122
4-[4-tert-butyl-2-(dimethoxyphosphorylamino)sulfanylphenyl]morpholine
CID 22758972
propan-2-yl morpholine-4-sulfonate
CID 58928705

Frequently Asked Questions

What is the IUPAC name of 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine?
The IUPAC name of 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine (CID 163490188) is 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine.
What is the SMILES notation for 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine?
The canonical SMILES for 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine is COP(=O)(N1CCOCC1)C(C)(C)C(C)C.
What is the InChIKey of 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine?
The InChIKey is CLYBFIPZDIDIAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24NO3P/c1-10(2)11(3,4)16(13,14-5)12-6-8-15-9-7-12/h10H,6-9H2,1-5H3.
What are the key properties of 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine?
4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine has a molecular weight of 249.29 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,3-dimethylbutan-2-yl(methoxy)phosphoryl]morpholine is sourced from PubChem (CID 163490188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).