(2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide

C13H26N2O4 — CID 96516458

IUPAC(2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide
SMILESCC[C@@H]1CN(C(=O)NCCOCCOC)C[C@H](C)O1
InChIInChI=1S/C13H26N2O4/c1-4-12-10-15(9-11(2)19-12)13(16)14-5-6-18-8-7-17-3/h11-12H,4-10H2,1-3H3,(H,14,16)/t11-,12+/m0/s1
InChIKeyBULJWOWMTLLMAG-NWDGAFQWSA-N
MW274.36 g/mol
LogP0.86
Rot. Bonds7

About (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide

(2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide (PubChem CID 96516458) has the molecular formula C13H26N2O4 and a molecular weight of 274.36 g/mol. Its IUPAC name is (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide.

Molecular Properties

Compound Name(2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide
PubChem CID96516458
Molecular FormulaC13H26N2O4
Molecular Weight274.36 g/mol
Exact Mass274.19
IUPAC Name(2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide
SMILESCC[C@@H]1CN(C(=O)NCCOCCOC)C[C@H](C)O1
InChIInChI=1S/C13H26N2O4/c1-4-12-10-15(9-11(2)19-12)13(16)14-5-6-18-8-7-17-3/h11-12H,4-10H2,1-3H3,(H,14,16)/t11-,12+/m0/s1
InChIKeyBULJWOWMTLLMAG-NWDGAFQWSA-N
XLogP0.86
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S,6S)-N-[2-[(2-cyclopentylacetyl)amino]ethyl]-2-ethyl-6-methylmorpholine-4-carboxamide
CID 96516498
N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperazine-1-carboxamide
CID 175748625
3-ethylsulfonyl-N-(2-methoxyethyl)azetidine-1-carboxamide
CID 121164595
tert-butyl (2S)-2-ethyl-6-methylmorpholine-4-carboxylate
CID 135742569
(2-ethyl-6-methylmorpholin-4-yl)-[4-(methoxymethyl)piperidin-4-yl]methanone;hydrochloride
CID 120625884
2-benzyl-6-methyl-N-propylmorpholine-4-carboxamide
CID 110644188
(3R)-1-[2-(2-methoxyethoxy)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 81119985
(1R,5S)-N-(3-ethoxypropyl)-7-(2-methoxyethyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
CID 163339993
(1-aminocyclopropyl)-(2-ethyl-6-methylmorpholin-4-yl)methanone;hydrochloride
CID 119751390
2-(cyclopropylmethylamino)-1-(2-ethyl-6-methylmorpholin-4-yl)ethanone;hydrochloride
CID 119751420
2-ethyl-N-(4-hydroxy-2-phenylbutyl)-6-methylmorpholine-4-carboxamide
CID 111455922
3-amino-1-(2-ethyl-6-methylmorpholin-4-yl)propan-1-one
CID 119304810

Frequently Asked Questions

What is the IUPAC name of (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide?
The IUPAC name of (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide (CID 96516458) is (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide.
What is the SMILES notation for (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide?
The canonical SMILES for (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide is CC[C@@H]1CN(C(=O)NCCOCCOC)C[C@H](C)O1.
What is the InChIKey of (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide?
The InChIKey is BULJWOWMTLLMAG-NWDGAFQWSA-N. The full InChI is InChI=1S/C13H26N2O4/c1-4-12-10-15(9-11(2)19-12)13(16)14-5-6-18-8-7-17-3/h11-12H,4-10H2,1-3H3,(H,14,16)/t11-,12+/m0/s1.
What are the key properties of (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide?
(2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 0.86, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-2-ethyl-N-[2-(2-methoxyethoxy)ethyl]-6-methylmorpholine-4-carboxamide is sourced from PubChem (CID 96516458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).