(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone

C10H18N2O3 — CID 106774354

IUPAC(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
SMILESC[C@@H]1COCCN1C(=O)C1COCC1N
InChIInChI=1S/C10H18N2O3/c1-7-4-14-3-2-12(7)10(13)8-5-15-6-9(8)11/h7-9H,2-6,11H2,1H3/t7-,8?,9?/m1/s1
InChIKeyJHMSOWZDVXBPPN-AFPNSQJFSA-N
MW214.26 g/mol
LogP-0.79
Rot. Bonds1

About (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone

(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone (PubChem CID 106774354) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
PubChem CID106774354
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
SMILESC[C@@H]1COCCN1C(=O)C1COCC1N
InChIInChI=1S/C10H18N2O3/c1-7-4-14-3-2-12(7)10(13)8-5-15-6-9(8)11/h7-9H,2-6,11H2,1H3/t7-,8?,9?/m1/s1
InChIKeyJHMSOWZDVXBPPN-AFPNSQJFSA-N
XLogP-0.79
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
The IUPAC name of (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone (CID 106774354) is (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone.
What is the SMILES notation for (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
The canonical SMILES for (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone is C[C@@H]1COCCN1C(=O)C1COCC1N.
What is the InChIKey of (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
The InChIKey is JHMSOWZDVXBPPN-AFPNSQJFSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-7-4-14-3-2-12(7)10(13)8-5-15-6-9(8)11/h7-9H,2-6,11H2,1H3/t7-,8?,9?/m1/s1.
What are the key properties of (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone has a molecular weight of 214.26 g/mol, XLogP of -0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone is sourced from PubChem (CID 106774354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).