4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide

C21H26N2O3 — CID 31460518

IUPAC4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
SMILESCOc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCOCC2)cc1
InChIInChI=1S/C21H26N2O3/c1-16-3-5-17(6-4-16)20(23-11-13-26-14-12-23)15-22-21(24)18-7-9-19(25-2)10-8-18/h3-10,20H,11-15H2,1-2H3,(H,22,24)/t20-/m1/s1
InChIKeyYMNSPCXLKGDJPK-HXUWFJFHSA-N
MW354.45 g/mol
LogP2.81
Rot. Bonds6

About 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide

4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide (PubChem CID 31460518) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
PubChem CID31460518
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
SMILESCOc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCOCC2)cc1
InChIInChI=1S/C21H26N2O3/c1-16-3-5-17(6-4-16)20(23-11-13-26-14-12-23)15-22-21(24)18-7-9-19(25-2)10-8-18/h3-10,20H,11-15H2,1-2H3,(H,22,24)/t20-/m1/s1
InChIKeyYMNSPCXLKGDJPK-HXUWFJFHSA-N
XLogP2.81
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 17011129
4-methyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 30834547
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-methoxybenzamide
CID 30834690
N-[(2R)-2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-4-methoxybenzamide
CID 34954942
N-[(2S)-2-[4-(dimethylamino)phenyl]-2-morpholin-4-ylethyl]-4-methoxybenzamide
CID 7496625
3-methoxy-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 17011132
3-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460638
3-methoxy-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-4-methylbenzamide
CID 18161673
4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 16804391
4-bromo-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 30834490
N-[(2S)-2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-4-methylbenzamide
CID 25484973
4-methoxy-N-[(2R)-2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]benzamide
CID 30834563

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
The IUPAC name of 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide (CID 31460518) is 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
The canonical SMILES for 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide is COc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N2CCOCC2)cc1.
What is the InChIKey of 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
The InChIKey is YMNSPCXLKGDJPK-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-16-3-5-17(6-4-16)20(23-11-13-26-14-12-23)15-22-21(24)18-7-9-19(25-2)10-8-18/h3-10,20H,11-15H2,1-2H3,(H,22,24)/t20-/m1/s1.
What are the key properties of 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide has a molecular weight of 354.45 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide is sourced from PubChem (CID 31460518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).