4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide

C21H25N3O3 — CID 16612017

IUPAC4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
SMILESCCc1ccc(C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1
InChIInChI=1S/C21H25N3O3/c1-2-16-3-5-17(6-4-16)21(26)23-19-9-7-18(8-10-19)22-20(25)15-24-11-13-27-14-12-24/h3-10H,2,11-15H2,1H3,(H,22,25)(H,23,26)
InChIKeyWULPRTDUJPKNQE-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.77
Rot. Bonds6

About 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide

4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide (PubChem CID 16612017) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
PubChem CID16612017
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC Name4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
SMILESCCc1ccc(C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1
InChIInChI=1S/C21H25N3O3/c1-2-16-3-5-17(6-4-16)21(26)23-19-9-7-18(8-10-19)22-20(25)15-24-11-13-27-14-12-24/h3-10H,2,11-15H2,1H3,(H,22,25)(H,23,26)
InChIKeyWULPRTDUJPKNQE-UHFFFAOYSA-N
XLogP2.77
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide
CID 110178513
3,4,5-triethoxy-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
CID 16611987
N-(4-ethylphenyl)-1-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
CID 53040752
ethane;N-(4-methylphenyl)-2-morpholin-4-ylacetamide
CID 142923820
2-morpholin-4-yl-N-[4-[(2-propylsulfanylacetyl)amino]phenyl]acetamide
CID 55831217
N-(4-acetylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 5132306
4-ethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164786
4-(cyclopropylsulfamoyl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
CID 24618223
N-(4-ethylphenyl)-2-(4-propylpiperazin-1-yl)acetamide
CID 22196973
N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]furan-2-carboxamide
CID 858393
3-(4-methylphenyl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide
CID 37154032
4-methyl-N-[4-(1,4-oxazepan-4-ylmethyl)phenyl]benzamide
CID 166858230

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide?
The IUPAC name of 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide (CID 16612017) is 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide?
The canonical SMILES for 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide is CCc1ccc(C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1.
What is the InChIKey of 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide?
The InChIKey is WULPRTDUJPKNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-2-16-3-5-17(6-4-16)21(26)23-19-9-7-18(8-10-19)22-20(25)15-24-11-13-27-14-12-24/h3-10H,2,11-15H2,1H3,(H,22,25)(H,23,26).
What are the key properties of 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide?
4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide has a molecular weight of 367.45 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide is sourced from PubChem (CID 16612017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).