2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide

C21H26N2O3 — CID 118784925

IUPAC2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide
SMILESCOCCC1CN(C(=O)Nc2ccc(-c3ccc(C)cc3)cc2)CCO1
InChIInChI=1S/C21H26N2O3/c1-16-3-5-17(6-4-16)18-7-9-19(10-8-18)22-21(24)23-12-14-26-20(15-23)11-13-25-2/h3-10,20H,11-15H2,1-2H3,(H,22,24)
InChIKeyNOPFRZJHXYVLTC-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.93
Rot. Bonds5

About 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide

2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide (PubChem CID 118784925) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide
PubChem CID118784925
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide
SMILESCOCCC1CN(C(=O)Nc2ccc(-c3ccc(C)cc3)cc2)CCO1
InChIInChI=1S/C21H26N2O3/c1-16-3-5-17(6-4-16)18-7-9-19(10-8-18)22-21(24)23-12-14-26-20(15-23)11-13-25-2/h3-10,20H,11-15H2,1-2H3,(H,22,24)
InChIKeyNOPFRZJHXYVLTC-UHFFFAOYSA-N
XLogP3.93
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-(4-methylphenyl)morpholine-4-carboxamide
CID 42884313
(2S)-2-(2-aminoethyl)-N-[4-(4-methoxyphenyl)phenyl]morpholine-4-carboxamide
CID 97437793
2-(2-aminoethyl)-N-[4-(4-methoxyphenyl)phenyl]morpholine-4-carboxamide
CID 72872596
(2S)-N-[3-(3-chlorophenyl)phenyl]-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 97437523
N-(3-cyano-4-ethoxyphenyl)-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 118769323
2-(2,5-dimethylphenyl)-1-[2-(2-methoxyethyl)morpholin-4-yl]ethanone
CID 91769226
(2S)-N-(2,3-difluorophenyl)-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 97278282
(2R)-N-(2,3-difluorophenyl)-2-(2-methoxyethyl)morpholine-4-carboxamide
CID 97278281
1-[2-(2-methoxyethyl)morpholin-4-yl]-2-[methyl-[(4-methylphenyl)methyl]amino]ethanone
CID 91840309
methyl 4-[[(2R)-2-ethylmorpholine-4-carbonyl]amino]benzoate
CID 94878692
methyl 4-[[(2S)-2-ethylmorpholine-4-carbonyl]amino]benzoate
CID 95160013
N-(4-butylphenyl)-2-(methoxymethyl)morpholine-4-carboxamide
CID 71992880

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide?
The IUPAC name of 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide (CID 118784925) is 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide.
What is the SMILES notation for 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide?
The canonical SMILES for 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide is COCCC1CN(C(=O)Nc2ccc(-c3ccc(C)cc3)cc2)CCO1.
What is the InChIKey of 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide?
The InChIKey is NOPFRZJHXYVLTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-16-3-5-17(6-4-16)18-7-9-19(10-8-18)22-21(24)23-12-14-26-20(15-23)11-13-25-2/h3-10,20H,11-15H2,1-2H3,(H,22,24).
What are the key properties of 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide?
2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-N-[4-(4-methylphenyl)phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 118784925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).