N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide

C22H27N3O3 — CID 9125046

IUPACN-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide
SMILESCNC(=O)c1ccc(CN(C)[C@@H](C(=O)N2CCOCC2)c2ccccc2)cc1
InChIInChI=1S/C22H27N3O3/c1-23-21(26)19-10-8-17(9-11-19)16-24(2)20(18-6-4-3-5-7-18)22(27)25-12-14-28-15-13-25/h3-11,20H,12-16H2,1-2H3,(H,23,26)/t20-/m1/s1
InChIKeyHTMNGENWNIYDET-HXUWFJFHSA-N
MW381.48 g/mol
LogP2.08
Rot. Bonds6

About N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide

N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide (PubChem CID 9125046) has the molecular formula C22H27N3O3 and a molecular weight of 381.48 g/mol. Its IUPAC name is N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide.

Molecular Properties

Compound NameN-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide
PubChem CID9125046
Molecular FormulaC22H27N3O3
Molecular Weight381.48 g/mol
Exact Mass381.21
IUPAC NameN-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide
SMILESCNC(=O)c1ccc(CN(C)[C@@H](C(=O)N2CCOCC2)c2ccccc2)cc1
InChIInChI=1S/C22H27N3O3/c1-23-21(26)19-10-8-17(9-11-19)16-24(2)20(18-6-4-3-5-7-18)22(27)25-12-14-28-15-13-25/h3-11,20H,12-16H2,1-2H3,(H,23,26)/t20-/m1/s1
InChIKeyHTMNGENWNIYDET-HXUWFJFHSA-N
XLogP2.08
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide with MolForge

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Related Compounds

(2R)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]-1-morpholin-4-yl-2-phenylethanone
CID 39973215
N-methyl-4-[[methyl-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]amino]methyl]benzamide
CID 9123829
2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl-methylamino]-1-morpholin-4-yl-2-phenylethanone
CID 42895204
(2S)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-2-phenyl-1-pyrrolidin-1-ylethanone
CID 8924310
2-[methyl-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]-N-(4-methylphenyl)acetamide
CID 8785626
(2R)-2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]-1-morpholin-4-yl-2-phenylethanone
CID 40855767
4-[[[1-(2,6-dimethylmorpholin-4-yl)-1-oxopropan-2-yl]-methylamino]methyl]-N-methylbenzamide
CID 51227491
4-[[[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-methylamino]methyl]-N-methylbenzamide
CID 51227478
(2S)-1-morpholin-4-yl-2-phenylbutan-1-one
CID 670056
N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]-2-phenylacetamide
CID 110286922
[4-[(dimethylamino)methyl]phenyl]-morpholin-4-ylmethanone
CID 60699283
1-benzyl-1,2-dimethyl-3-(3-morpholin-4-yl-3-oxo-2-phenylpropyl)guanidine;hydroiodide
CID 110951665

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide?
The IUPAC name of N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide (CID 9125046) is N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide.
What is the SMILES notation for N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide?
The canonical SMILES for N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide is CNC(=O)c1ccc(CN(C)[C@@H](C(=O)N2CCOCC2)c2ccccc2)cc1.
What is the InChIKey of N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide?
The InChIKey is HTMNGENWNIYDET-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H27N3O3/c1-23-21(26)19-10-8-17(9-11-19)16-24(2)20(18-6-4-3-5-7-18)22(27)25-12-14-28-15-13-25/h3-11,20H,12-16H2,1-2H3,(H,23,26)/t20-/m1/s1.
What are the key properties of N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide?
N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide has a molecular weight of 381.48 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[[methyl-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]methyl]benzamide is sourced from PubChem (CID 9125046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).