N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide

C23H28N2O4 — CID 46041170

IUPACN-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide
SMILESCOCCN(CC1CN(C(=O)c2ccc(C)cc2)CCO1)C(=O)c1ccccc1
InChIInChI=1S/C23H28N2O4/c1-18-8-10-20(11-9-18)23(27)25-13-15-29-21(17-25)16-24(12-14-28-2)22(26)19-6-4-3-5-7-19/h3-11,21H,12-17H2,1-2H3
InChIKeyJCWFHPCLQKKYST-UHFFFAOYSA-N
MW396.49 g/mol
LogP2.62
Rot. Bonds7

About N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide

N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide (PubChem CID 46041170) has the molecular formula C23H28N2O4 and a molecular weight of 396.49 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide
PubChem CID46041170
Molecular FormulaC23H28N2O4
Molecular Weight396.49 g/mol
Exact Mass396.20
IUPAC NameN-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide
SMILESCOCCN(CC1CN(C(=O)c2ccc(C)cc2)CCO1)C(=O)c1ccccc1
InChIInChI=1S/C23H28N2O4/c1-18-8-10-20(11-9-18)23(27)25-13-15-29-21(17-25)16-24(12-14-28-2)22(26)19-6-4-3-5-7-19/h3-11,21H,12-17H2,1-2H3
InChIKeyJCWFHPCLQKKYST-UHFFFAOYSA-N
XLogP2.62
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-4-methyl-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide
CID 46059667
N-[[4-(2-methoxybenzoyl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)-4-methylbenzamide
CID 42861605
4-methyl-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]-N-(2-methylpropyl)benzamide
CID 46059580
N-[[(2S)-4-(1-hydroxy-2-methylpropan-2-yl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 92989560
N-[[(2S)-4-[(2S)-2-hydroxy-3-methoxypropyl]morpholin-2-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 92984293
N-[[4-(4-chlorobenzoyl)morpholin-2-yl]methyl]-N-(2-morpholin-4-ylethyl)benzamide
CID 42861940
4-fluoro-N-(2-methoxyethyl)-N-[[4-[(4-methylphenyl)methyl]morpholin-2-yl]methyl]benzamide
CID 46041263
N-[2-(dimethylamino)ethyl]-N-[[4-(2-methoxyacetyl)morpholin-2-yl]methyl]benzamide
CID 42861666
N-[2-(dimethylamino)ethyl]-4-fluoro-N-[[(2R)-4-(4-fluorobenzoyl)morpholin-2-yl]methyl]benzamide
CID 93338217
N-[2-(dimethylamino)ethyl]-4-fluoro-N-[[4-(4-fluorobenzoyl)morpholin-2-yl]methyl]benzamide
CID 46059702
N-[[4-(2-hydroxy-3-propan-2-yloxypropyl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)-4-methylbenzamide
CID 46060172
N-[[(2S)-4-(2,4-difluorobenzoyl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)-4-(trifluoromethyl)benzamide
CID 93338336

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide?
The IUPAC name of N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide (CID 46041170) is N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide is COCCN(CC1CN(C(=O)c2ccc(C)cc2)CCO1)C(=O)c1ccccc1.
What is the InChIKey of N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide?
The InChIKey is JCWFHPCLQKKYST-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O4/c1-18-8-10-20(11-9-18)23(27)25-13-15-29-21(17-25)16-24(12-14-28-2)22(26)19-6-4-3-5-7-19/h3-11,21H,12-17H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide?
N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide has a molecular weight of 396.49 g/mol, XLogP of 2.62, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[[4-(4-methylbenzoyl)morpholin-2-yl]methyl]benzamide is sourced from PubChem (CID 46041170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).