(2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium

C11H21N2O3+ — CID 7437131

IUPAC(2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium
SMILESO=C(C[NH2+]C[C@@H]1CCCO1)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c14-11(13-3-6-15-7-4-13)9-12-8-10-2-1-5-16-10/h10,12H,1-9H2/p+1/t10-/m0/s1
InChIKeyYBIWMVPCKZDFKO-JTQLQIEISA-O
MW229.30 g/mol
LogP-1.41
Rot. Bonds4

About (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium

(2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium (PubChem CID 7437131) has the molecular formula C11H21N2O3+ and a molecular weight of 229.30 g/mol. Its IUPAC name is (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium.

Molecular Properties

Compound Name(2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium
PubChem CID7437131
Molecular FormulaC11H21N2O3+
Molecular Weight229.30 g/mol
Exact Mass229.15
IUPAC Name(2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium
SMILESO=C(C[NH2+]C[C@@H]1CCCO1)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c14-11(13-3-6-15-7-4-13)9-12-8-10-2-1-5-16-10/h10,12H,1-9H2/p+1/t10-/m0/s1
InChIKeyYBIWMVPCKZDFKO-JTQLQIEISA-O
XLogP-1.41
TPSA55.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 5-1.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium?
The IUPAC name of (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium (CID 7437131) is (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium.
What is the SMILES notation for (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium?
The canonical SMILES for (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium is O=C(C[NH2+]C[C@@H]1CCCO1)N1CCOCC1.
What is the InChIKey of (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium?
The InChIKey is YBIWMVPCKZDFKO-JTQLQIEISA-O. The full InChI is InChI=1S/C11H20N2O3/c14-11(13-3-6-15-7-4-13)9-12-8-10-2-1-5-16-10/h10,12H,1-9H2/p+1/t10-/m0/s1.
What are the key properties of (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium?
(2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium has a molecular weight of 229.30 g/mol, XLogP of -1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-2-oxoethyl)-[[(2S)-oxolan-2-yl]methyl]azanium is sourced from PubChem (CID 7437131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).