(2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide

C13H18N2O3 — CID 95841946

IUPAC(2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide
SMILESCNC(=O)[C@H]1CN(c2cccc(OC)c2)CCO1
InChIInChI=1S/C13H18N2O3/c1-14-13(16)12-9-15(6-7-18-12)10-4-3-5-11(8-10)17-2/h3-5,8,12H,6-7,9H2,1-2H3,(H,14,16)/t12-/m1/s1
InChIKeyAOYMRKIBQZRSIB-GFCCVEGCSA-N
MW250.30 g/mol
LogP0.65
Rot. Bonds3

About (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide

(2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide (PubChem CID 95841946) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide
PubChem CID95841946
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name(2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide
SMILESCNC(=O)[C@H]1CN(c2cccc(OC)c2)CCO1
InChIInChI=1S/C13H18N2O3/c1-14-13(16)12-9-15(6-7-18-12)10-4-3-5-11(8-10)17-2/h3-5,8,12H,6-7,9H2,1-2H3,(H,14,16)/t12-/m1/s1
InChIKeyAOYMRKIBQZRSIB-GFCCVEGCSA-N
XLogP0.65
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclobutyl-4-(3-methoxyphenyl)morpholine-2-carboxamide
CID 110254136
4-(5-methoxy-1,3-benzothiazol-2-yl)-N-methylmorpholine-2-carboxamide
CID 166602705
4-[2-(7-methoxynaphthalen-1-yl)acetyl]-N-methylmorpholine-2-carboxamide
CID 126787903
methyl 4-(3-nitrophenyl)morpholine-2-carboxylate
CID 78926285
(3S)-1-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid
CID 28875723
(2S)-N-[3-(3-methoxyphenyl)propyl]-4-pyrimidin-2-ylmorpholine-2-carboxamide
CID 92632963
(2S)-4-(3-fluorophenyl)morpholine-2-carboxylic acid
CID 95804351
methyl 4-[2-(methylcarbamoyl)-4-pyridinyl]morpholine-2-carboxylate
CID 115538541
(2R)-4-phenylmorpholine-2-carboxylic acid
CID 95804269
3-methoxy-N-[2-(4-phenylmorpholin-2-yl)ethyl]benzamide
CID 110709827
4-(2-hydroxy-6-methoxyphenyl)sulfonyl-N-methylmorpholine-2-carboxamide
CID 138013474
N-[(3R)-1-(3-methoxyphenyl)piperidin-3-yl]cyclopropanecarboxamide
CID 53318242

Frequently Asked Questions

What is the IUPAC name of (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide?
The IUPAC name of (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide (CID 95841946) is (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide.
What is the SMILES notation for (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide?
The canonical SMILES for (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide is CNC(=O)[C@H]1CN(c2cccc(OC)c2)CCO1.
What is the InChIKey of (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide?
The InChIKey is AOYMRKIBQZRSIB-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-14-13(16)12-9-15(6-7-18-12)10-4-3-5-11(8-10)17-2/h3-5,8,12H,6-7,9H2,1-2H3,(H,14,16)/t12-/m1/s1.
What are the key properties of (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide?
(2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(3-methoxyphenyl)-N-methylmorpholine-2-carboxamide is sourced from PubChem (CID 95841946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).