ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate

C11H20N2O4 — CID 129398069

IUPACethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate
SMILESCCOC(=O)CCN1CCO[C@@H](C(=O)NC)C1
InChIInChI=1S/C11H20N2O4/c1-3-16-10(14)4-5-13-6-7-17-9(8-13)11(15)12-2/h9H,3-8H2,1-2H3,(H,12,15)/t9-/m1/s1
InChIKeyHPSIMQAKIFBNJZ-SECBINFHSA-N
MW244.29 g/mol
LogP-0.61
Rot. Bonds5

About ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate

ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate (PubChem CID 129398069) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate.

Molecular Properties

Compound Nameethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate
PubChem CID129398069
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Nameethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate
SMILESCCOC(=O)CCN1CCO[C@@H](C(=O)NC)C1
InChIInChI=1S/C11H20N2O4/c1-3-16-10(14)4-5-13-6-7-17-9(8-13)11(15)12-2/h9H,3-8H2,1-2H3,(H,12,15)/t9-/m1/s1
InChIKeyHPSIMQAKIFBNJZ-SECBINFHSA-N
XLogP-0.61
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-fluoroethyl)-N-methylmorpholine-2-carboxamide
CID 130629034
ethyl 3-[4-(methylcarbamoyl)piperidin-1-yl]propanoate
CID 60705415
ethyl 6-[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]hexanoate
CID 79827518
methyl 4-(2-ethoxy-2-oxoethyl)morpholine-2-carboxylate
CID 78927241
4-[(2-ethylpyrazol-3-yl)methyl]-N-methylmorpholine-2-carboxamide
CID 86786686
ethyl 3-[3-(3-ethoxy-3-oxopropyl)imidazolidin-1-yl]propanoate
CID 139659008
ethyl 3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanoate
CID 25113400
ethyl 3-[3-(dimethylamino)pyrrolidin-1-yl]propanoate
CID 63164459
methyl 4-(2-ethoxyethyl)morpholine-2-carboxylate
CID 78927291
tert-butyl N-[1-[2-(methylcarbamoyl)morpholin-4-yl]butan-2-yl]carbamate
CID 136571480
ethyl 5-[(2R)-2-(azidomethyl)morpholin-4-yl]pentanoate
CID 59448013
N-methyl-3-(2-methylmorpholin-4-yl)propanamide
CID 131041683

Frequently Asked Questions

What is the IUPAC name of ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate?
The IUPAC name of ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate (CID 129398069) is ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate.
What is the SMILES notation for ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate?
The canonical SMILES for ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate is CCOC(=O)CCN1CCO[C@@H](C(=O)NC)C1.
What is the InChIKey of ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate?
The InChIKey is HPSIMQAKIFBNJZ-SECBINFHSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-3-16-10(14)4-5-13-6-7-17-9(8-13)11(15)12-2/h9H,3-8H2,1-2H3,(H,12,15)/t9-/m1/s1.
What are the key properties of ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate?
ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate has a molecular weight of 244.29 g/mol, XLogP of -0.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-[(2R)-2-(methylcarbamoyl)morpholin-4-yl]propanoate is sourced from PubChem (CID 129398069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).