(3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide

C15H22N2O3 — CID 124513206

IUPAC(3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide
SMILESCc1ccccc1OCCN(C)C(=O)[C@H]1COCCN1
InChIInChI=1S/C15H22N2O3/c1-12-5-3-4-6-14(12)20-10-8-17(2)15(18)13-11-19-9-7-16-13/h3-6,13,16H,7-11H2,1-2H3/t13-/m1/s1
InChIKeyITGKSOQPUMTEFP-CYBMUJFWSA-N
MW278.35 g/mol
LogP0.82
Rot. Bonds5

About (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide

(3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide (PubChem CID 124513206) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide
PubChem CID124513206
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name(3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide
SMILESCc1ccccc1OCCN(C)C(=O)[C@H]1COCCN1
InChIInChI=1S/C15H22N2O3/c1-12-5-3-4-6-14(12)20-10-8-17(2)15(18)13-11-19-9-7-16-13/h3-6,13,16H,7-11H2,1-2H3/t13-/m1/s1
InChIKeyITGKSOQPUMTEFP-CYBMUJFWSA-N
XLogP0.82
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3S)-N,2-dimethyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide
CID 120920151
N-methyl-N-[(2-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119681680
N-methyl-N-[3-(2-methylphenoxy)propyl]piperidine-2-carboxamide
CID 119298328
(2S,4S)-N,2-dimethyl-N-[2-(2-methylphenoxy)ethyl]piperidine-4-carboxamide
CID 120618998
N-[2-(4-fluorophenyl)ethyl]-N-methylmorpholine-3-carboxamide
CID 115177667
N-methyl-N-[3-(2-methylphenoxy)propyl]-2-oxoimidazolidine-4-carboxamide
CID 71877849
N-methyl-N-[2-(5-methylfuran-2-yl)ethyl]morpholine-3-carboxamide
CID 115177679
[2-(2-methoxyethoxy)phenyl]-morpholin-3-ylmethanone
CID 116576351
N-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-methylmorpholine-3-carboxamide;hydrochloride
CID 119690480
4-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]cyclopent-2-ene-1-carboxamide
CID 79210479
N-methyl-N-[2-(1H-pyrrol-3-yl)ethyl]morpholine-3-carboxamide
CID 115177671
(2S)-N-[2-(2-chlorophenoxy)ethyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119695444

Frequently Asked Questions

What is the IUPAC name of (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide?
The IUPAC name of (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide (CID 124513206) is (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide.
What is the SMILES notation for (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide?
The canonical SMILES for (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide is Cc1ccccc1OCCN(C)C(=O)[C@H]1COCCN1.
What is the InChIKey of (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide?
The InChIKey is ITGKSOQPUMTEFP-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-12-5-3-4-6-14(12)20-10-8-17(2)15(18)13-11-19-9-7-16-13/h3-6,13,16H,7-11H2,1-2H3/t13-/m1/s1.
What are the key properties of (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide?
(3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 0.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-methyl-N-[2-(2-methylphenoxy)ethyl]morpholine-3-carboxamide is sourced from PubChem (CID 124513206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).