2-morpholin-4-ylpropyl 2-methylpropanoate

C11H21NO3 — CID 131966450

IUPAC2-morpholin-4-ylpropyl 2-methylpropanoate
SMILESCC(C)C(=O)OCC(C)N1CCOCC1
InChIInChI=1S/C11H21NO3/c1-9(2)11(13)15-8-10(3)12-4-6-14-7-5-12/h9-10H,4-8H2,1-3H3
InChIKeySAIQSPDXNGBGAK-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.91
Rot. Bonds4

About 2-morpholin-4-ylpropyl 2-methylpropanoate

2-morpholin-4-ylpropyl 2-methylpropanoate (PubChem CID 131966450) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 2-morpholin-4-ylpropyl 2-methylpropanoate.

Molecular Properties

Compound Name2-morpholin-4-ylpropyl 2-methylpropanoate
PubChem CID131966450
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name2-morpholin-4-ylpropyl 2-methylpropanoate
SMILESCC(C)C(=O)OCC(C)N1CCOCC1
InChIInChI=1S/C11H21NO3/c1-9(2)11(13)15-8-10(3)12-4-6-14-7-5-12/h9-10H,4-8H2,1-3H3
InChIKeySAIQSPDXNGBGAK-UHFFFAOYSA-N
XLogP0.91
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-propan-2-yloxypropan-2-yl)morpholine
CID 164739188
ethane;2-morpholin-4-ylethyl 2-methylpropanoate
CID 156731056
N-(2-morpholin-4-ylpropoxy)propan-2-imine
CID 142204352
ethane;2-morpholin-4-ylpropan-1-ol
CID 142923575
methyl (2R)-2-morpholin-4-ylpropanoate
CID 30030777
2-amino-N-(2-morpholin-4-ylpropyl)acetamide
CID 83620199
ethane;3-morpholin-4-ylpropyl 2-methylpropanoate
CID 172564142
methyl 2-[4-[(2S)-2-morpholin-4-ylpropoxy]phenyl]acetate
CID 169157685
2-morpholin-4-ylpropyl prop-2-enoate;propyl 2-morpholin-4-ylprop-2-enoate
CID 146541159
2-hydroxyethyl 2-methylpropanoate;2-morpholin-4-ylethyl 2-methylpropanoate
CID 158502443
fluoro 2-morpholin-4-ylpropanoate
CID 169191902
methyl (2R)-3-methyl-2-morpholin-4-ylbutanoate
CID 30031078

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylpropyl 2-methylpropanoate?
The IUPAC name of 2-morpholin-4-ylpropyl 2-methylpropanoate (CID 131966450) is 2-morpholin-4-ylpropyl 2-methylpropanoate.
What is the SMILES notation for 2-morpholin-4-ylpropyl 2-methylpropanoate?
The canonical SMILES for 2-morpholin-4-ylpropyl 2-methylpropanoate is CC(C)C(=O)OCC(C)N1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylpropyl 2-methylpropanoate?
The InChIKey is SAIQSPDXNGBGAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-9(2)11(13)15-8-10(3)12-4-6-14-7-5-12/h9-10H,4-8H2,1-3H3.
What are the key properties of 2-morpholin-4-ylpropyl 2-methylpropanoate?
2-morpholin-4-ylpropyl 2-methylpropanoate has a molecular weight of 215.29 g/mol, XLogP of 0.91, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylpropyl 2-methylpropanoate is sourced from PubChem (CID 131966450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).