(2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide

C15H22N2O4 — CID 128987031

IUPAC(2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide
SMILESCOc1cccc(OCCN2CCO[C@H](C)[C@H]2C(N)=O)c1
InChIInChI=1S/C15H22N2O4/c1-11-14(15(16)18)17(6-8-20-11)7-9-21-13-5-3-4-12(10-13)19-2/h3-5,10-11,14H,6-9H2,1-2H3,(H2,16,18)/t11-,14+/m1/s1
InChIKeyJYCOMBHHWALPCH-RISCZKNCSA-N
MW294.35 g/mol
LogP0.65
Rot. Bonds6

About (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide

(2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide (PubChem CID 128987031) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name(2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide
PubChem CID128987031
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name(2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide
SMILESCOc1cccc(OCCN2CCO[C@H](C)[C@H]2C(N)=O)c1
InChIInChI=1S/C15H22N2O4/c1-11-14(15(16)18)17(6-8-20-11)7-9-21-13-5-3-4-12(10-13)19-2/h3-5,10-11,14H,6-9H2,1-2H3,(H2,16,18)/t11-,14+/m1/s1
InChIKeyJYCOMBHHWALPCH-RISCZKNCSA-N
XLogP0.65
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S)-4-[(3-methoxy-4-methylphenyl)methyl]-2-methylmorpholine-3-carboxamide
CID 128983267
trans-(1R,2S)-2-[(3S)-4-[2-(3-methoxyphenoxy)ethyl]morpholin-3-yl]cyclopentan-1-ol
CID 129484070
(2R)-2-amino-1-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-1-yl]propan-1-one
CID 120873129
(2R,3S)-4-(3-hydroxy-3-methylbutyl)-2-methylmorpholine-3-carboxamide
CID 128986958
2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride
CID 23620383
4-[2-(3-methoxyphenoxy)ethyl]-3-(1-methylpyrrol-2-yl)morpholine
CID 86803794
4-[2-(3-carbamothioylphenoxy)ethyl]morpholine-3-carboxamide
CID 83098097
1-[3-(3-methoxyphenoxy)propyl]piperidin-4-amine
CID 28802855
1-[6-(3-methoxyphenoxy)hexyl]-4-methylpiperidine
CID 11836207
1-[(2R,4S)-4-amino-2-methylpiperidin-1-yl]-2-(3-methoxyphenoxy)ethanone
CID 124687501
1-[3-(3-methoxyphenoxy)propyl]piperidine-2-carboxylic acid
CID 82224106
cis-(1R,2S)-2-[4-[2-(3-methoxyphenoxy)ethyl]piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 24984707

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide?
The IUPAC name of (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide (CID 128987031) is (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide.
What is the SMILES notation for (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide?
The canonical SMILES for (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide is COc1cccc(OCCN2CCO[C@H](C)[C@H]2C(N)=O)c1.
What is the InChIKey of (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide?
The InChIKey is JYCOMBHHWALPCH-RISCZKNCSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-11-14(15(16)18)17(6-8-20-11)7-9-21-13-5-3-4-12(10-13)19-2/h3-5,10-11,14H,6-9H2,1-2H3,(H2,16,18)/t11-,14+/m1/s1.
What are the key properties of (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide?
(2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide has a molecular weight of 294.35 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-4-[2-(3-methoxyphenoxy)ethyl]-2-methylmorpholine-3-carboxamide is sourced from PubChem (CID 128987031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).