4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide

C15H22N4O3 — CID 119863887

IUPAC4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
SMILESNc1ccc(C(=O)NCC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C15H22N4O3/c16-13-3-1-12(2-4-13)15(21)18-11-14(20)17-5-6-19-7-9-22-10-8-19/h1-4H,5-11,16H2,(H,17,20)(H,18,21)
InChIKeySULUUHGPBHWOKJ-UHFFFAOYSA-N
MW306.37 g/mol
LogP-0.55
Rot. Bonds6

About 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide

4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide (PubChem CID 119863887) has the molecular formula C15H22N4O3 and a molecular weight of 306.37 g/mol. Its IUPAC name is 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
PubChem CID119863887
Molecular FormulaC15H22N4O3
Molecular Weight306.37 g/mol
Exact Mass306.17
IUPAC Name4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
SMILESNc1ccc(C(=O)NCC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C15H22N4O3/c16-13-3-1-12(2-4-13)15(21)18-11-14(20)17-5-6-19-7-9-22-10-8-19/h1-4H,5-11,16H2,(H,17,20)(H,18,21)
InChIKeySULUUHGPBHWOKJ-UHFFFAOYSA-N
XLogP-0.55
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24595498
4-amino-N-[3-oxo-3-(2-piperidin-1-ylethylamino)propyl]benzamide
CID 166390762
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
5-bromo-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]furan-2-carboxamide
CID 51163910
3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
CID 110285157
4-bromo-N-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]benzamide
CID 26697005
N-(2-morpholin-4-ylethyl)-4-sulfamoylbenzamide
CID 25060315
4-butoxy-N-[2-(4-morpholin-4-ylbutylamino)-2-oxoethyl]benzamide
CID 55848187
4-N-tert-butyl-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045886
2-(2-aminophenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 16782251
1-N,4-N-bis(3-morpholin-4-ylpropyl)benzene-1,4-dicarboxamide;hydrochloride
CID 54609927
2-(5-amino-2-oxo-1-pyridinyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 62815288

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
The IUPAC name of 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide (CID 119863887) is 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide is Nc1ccc(C(=O)NCC(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
The InChIKey is SULUUHGPBHWOKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O3/c16-13-3-1-12(2-4-13)15(21)18-11-14(20)17-5-6-19-7-9-22-10-8-19/h1-4H,5-11,16H2,(H,17,20)(H,18,21).
What are the key properties of 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide?
4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide has a molecular weight of 306.37 g/mol, XLogP of -0.55, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 119863887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).