(2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide

C16H24N2O5 — CID 95761707

IUPAC(2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide
SMILESCOc1cc(OC)c(CNC(=O)N2CCO[C@@H](C)C2)c(OC)c1
InChIInChI=1S/C16H24N2O5/c1-11-10-18(5-6-23-11)16(19)17-9-13-14(21-3)7-12(20-2)8-15(13)22-4/h7-8,11H,5-6,9-10H2,1-4H3,(H,17,19)/t11-/m0/s1
InChIKeyCZILGTLCXULJQH-NSHDSACASA-N
MW324.38 g/mol
LogP1.64
Rot. Bonds5

About (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide

(2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide (PubChem CID 95761707) has the molecular formula C16H24N2O5 and a molecular weight of 324.38 g/mol. Its IUPAC name is (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide
PubChem CID95761707
Molecular FormulaC16H24N2O5
Molecular Weight324.38 g/mol
Exact Mass324.17
IUPAC Name(2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide
SMILESCOc1cc(OC)c(CNC(=O)N2CCO[C@@H](C)C2)c(OC)c1
InChIInChI=1S/C16H24N2O5/c1-11-10-18(5-6-23-11)16(19)17-9-13-14(21-3)7-12(20-2)8-15(13)22-4/h7-8,11H,5-6,9-10H2,1-4H3,(H,17,19)/t11-/m0/s1
InChIKeyCZILGTLCXULJQH-NSHDSACASA-N
XLogP1.64
TPSA69.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3,5-dimethoxyphenyl)-[(2R)-2-methylmorpholin-4-yl]methanone
CID 51710349
3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide
CID 41247421
(1R,8S)-N-[(2,4,6-trimethoxyphenyl)methyl]-4-azatricyclo[4.3.1.13,8]undecane-4-carboxamide
CID 95237359
N-[(5-bromothiophen-3-yl)methyl]-2-methylmorpholine-4-carboxamide
CID 47253703
2-methyl-5-[[(2-methylmorpholine-4-carbonyl)amino]methyl]furan-3-carboxylic acid
CID 61186721
(3R)-N-[(2,4-dimethoxyphenyl)methyl]-3-methylpiperidine-1-carboxamide
CID 95663808
(3-methoxyphenyl)-[(2S)-2-methylmorpholin-4-yl]methanone
CID 51710348
(2S)-N-[(2S)-3-(2-methoxyphenyl)sulfanyl-2-methylpropyl]-2-methylmorpholine-4-carboxamide
CID 95760588
methyl 5-methoxy-2-[2-(2-methylmorpholin-4-yl)-2-oxoethoxy]benzoate
CID 47069672
(2-bromo-4-methoxyphenyl)-[(2S)-2-methylmorpholin-4-yl]methanone
CID 172647327
2-[3-(methylamino)piperidin-1-yl]-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide
CID 119920099
(2R)-N-[[1-(3-methoxyphenyl)pyrazol-4-yl]methyl]-2-methyl-1,4-oxazepane-4-carboxamide
CID 126446890

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide?
The IUPAC name of (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide (CID 95761707) is (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide.
What is the SMILES notation for (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide?
The canonical SMILES for (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide is COc1cc(OC)c(CNC(=O)N2CCO[C@@H](C)C2)c(OC)c1.
What is the InChIKey of (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide?
The InChIKey is CZILGTLCXULJQH-NSHDSACASA-N. The full InChI is InChI=1S/C16H24N2O5/c1-11-10-18(5-6-23-11)16(19)17-9-13-14(21-3)7-12(20-2)8-15(13)22-4/h7-8,11H,5-6,9-10H2,1-4H3,(H,17,19)/t11-/m0/s1.
What are the key properties of (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide?
(2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide is sourced from PubChem (CID 95761707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).