N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide

C17H24ClN3O3 — CID 113053679

IUPACN-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide
SMILESCC(=O)N(CCNC(=O)c1ccccc1Cl)CCN1CCOCC1
InChIInChI=1S/C17H24ClN3O3/c1-14(22)21(9-8-20-10-12-24-13-11-20)7-6-19-17(23)15-4-2-3-5-16(15)18/h2-5H,6-13H2,1H3,(H,19,23)
InChIKeyOSXQXUXVQXVDID-UHFFFAOYSA-N
MW353.85 g/mol
LogP1.25
Rot. Bonds7

About N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide

N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide (PubChem CID 113053679) has the molecular formula C17H24ClN3O3 and a molecular weight of 353.85 g/mol. Its IUPAC name is N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide.

Molecular Properties

Compound NameN-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide
PubChem CID113053679
Molecular FormulaC17H24ClN3O3
Molecular Weight353.85 g/mol
Exact Mass353.15
IUPAC NameN-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide
SMILESCC(=O)N(CCNC(=O)c1ccccc1Cl)CCN1CCOCC1
InChIInChI=1S/C17H24ClN3O3/c1-14(22)21(9-8-20-10-12-24-13-11-20)7-6-19-17(23)15-4-2-3-5-16(15)18/h2-5H,6-13H2,1H3,(H,19,23)
InChIKeyOSXQXUXVQXVDID-UHFFFAOYSA-N
XLogP1.25
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.85
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2,6-dimethoxybenzamide
CID 113053665
N-[2-[acetyl-[2-(dimethylamino)ethyl]amino]ethyl]-2-chlorobenzamide
CID 113053554
N-[2-[acetyl-[3-(dimethylamino)propyl]amino]ethyl]-2-chlorobenzamide
CID 113053783
N-[2-(benzenesulfonamido)ethyl]-N-(2-morpholin-4-ylethyl)acetamide
CID 113053710
2-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide;hydrochloride
CID 2941366
3-[acetyl-[(2-chlorophenyl)methyl]amino]-N-(2-morpholin-4-ylethyl)propanamide
CID 113119422
N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-3-methylbutanamide
CID 113053643
N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-ylbenzamide
CID 168512683
N-[2-[acetyl-[2-(cyclohexen-1-yl)ethyl]amino]ethyl]-2-chlorobenzamide
CID 113053069
5-[(2-chlorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-ylbenzamide
CID 1063900
2-chloro-N-(2-methyl-3-morpholin-4-ylpropyl)benzamide
CID 110441973

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide?
The IUPAC name of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide (CID 113053679) is N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide.
What is the SMILES notation for N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide?
The canonical SMILES for N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide is CC(=O)N(CCNC(=O)c1ccccc1Cl)CCN1CCOCC1.
What is the InChIKey of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide?
The InChIKey is OSXQXUXVQXVDID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClN3O3/c1-14(22)21(9-8-20-10-12-24-13-11-20)7-6-19-17(23)15-4-2-3-5-16(15)18/h2-5H,6-13H2,1H3,(H,19,23).
What are the key properties of N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide?
N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide has a molecular weight of 353.85 g/mol, XLogP of 1.25, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide is sourced from PubChem (CID 113053679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).