(2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one

C10H17NO3 — CID 59430741

IUPAC(2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one
SMILESC=CCO[C@H](C)C(=O)N1CCOCC1
InChIInChI=1S/C10H17NO3/c1-3-6-14-9(2)10(12)11-4-7-13-8-5-11/h3,9H,1,4-8H2,2H3/t9-/m1/s1
InChIKeyDMNRBGUEFMBWNR-SECBINFHSA-N
MW199.25 g/mol
LogP0.44
Rot. Bonds4

About (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one

(2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one (PubChem CID 59430741) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one.

Molecular Properties

Compound Name(2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one
PubChem CID59430741
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name(2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one
SMILESC=CCO[C@H](C)C(=O)N1CCOCC1
InChIInChI=1S/C10H17NO3/c1-3-6-14-9(2)10(12)11-4-7-13-8-5-11/h3,9H,1,4-8H2,2H3/t9-/m1/s1
InChIKeyDMNRBGUEFMBWNR-SECBINFHSA-N
XLogP0.44
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one?
The IUPAC name of (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one (CID 59430741) is (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one.
What is the SMILES notation for (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one?
The canonical SMILES for (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one is C=CCO[C@H](C)C(=O)N1CCOCC1.
What is the InChIKey of (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one?
The InChIKey is DMNRBGUEFMBWNR-SECBINFHSA-N. The full InChI is InChI=1S/C10H17NO3/c1-3-6-14-9(2)10(12)11-4-7-13-8-5-11/h3,9H,1,4-8H2,2H3/t9-/m1/s1.
What are the key properties of (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one?
(2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one has a molecular weight of 199.25 g/mol, XLogP of 0.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-morpholin-4-yl-2-prop-2-enoxypropan-1-one is sourced from PubChem (CID 59430741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).