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

C20H23ClN2O2 — CID 16804391

IUPAC4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
SMILESCc1ccc(C(CNC(=O)c2ccc(Cl)cc2)N2CCOCC2)cc1
InChIInChI=1S/C20H23ClN2O2/c1-15-2-4-16(5-3-15)19(23-10-12-25-13-11-23)14-22-20(24)17-6-8-18(21)9-7-17/h2-9,19H,10-14H2,1H3,(H,22,24)
InChIKeyKMTNKNGXFDESNL-UHFFFAOYSA-N
MW358.87 g/mol
LogP3.45
Rot. Bonds5

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

4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide (PubChem CID 16804391) has the molecular formula C20H23ClN2O2 and a molecular weight of 358.87 g/mol. Its IUPAC name is 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
PubChem CID16804391
Molecular FormulaC20H23ClN2O2
Molecular Weight358.87 g/mol
Exact Mass358.14
IUPAC Name4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
SMILESCc1ccc(C(CNC(=O)c2ccc(Cl)cc2)N2CCOCC2)cc1
InChIInChI=1S/C20H23ClN2O2/c1-15-2-4-16(5-3-15)19(23-10-12-25-13-11-23)14-22-20(24)17-6-8-18(21)9-7-17/h2-9,19H,10-14H2,1H3,(H,22,24)
InChIKeyKMTNKNGXFDESNL-UHFFFAOYSA-N
XLogP3.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.87
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 30834547
4-bromo-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 30834490
N-[(2S)-2-(4-chlorophenyl)-2-piperidin-1-ylethyl]-4-methylbenzamide
CID 40782504
4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460518
N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-(trifluoromethyl)benzamide
CID 51641243
4-methoxy-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 17011129
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-6-methylpyridine-3-carboxamide
CID 60597091
N-[(4-chlorophenyl)methyl]-N'-[(2R)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]oxamide
CID 30835189
N-[(2S)-2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-4-methylbenzamide
CID 25484973
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]propanamide
CID 47459894
1-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-3-(2-methylpropyl)urea
CID 110621889
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-4-fluoro-3-(trifluoromethyl)benzamide
CID 60596930

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
The IUPAC name of 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide (CID 16804391) is 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
The canonical SMILES for 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide is Cc1ccc(C(CNC(=O)c2ccc(Cl)cc2)N2CCOCC2)cc1.
What is the InChIKey of 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
The InChIKey is KMTNKNGXFDESNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O2/c1-15-2-4-16(5-3-15)19(23-10-12-25-13-11-23)14-22-20(24)17-6-8-18(21)9-7-17/h2-9,19H,10-14H2,1H3,(H,22,24).
What are the key properties of 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide?
4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide has a molecular weight of 358.87 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide is sourced from PubChem (CID 16804391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).