N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide

C15H22ClN2O2+ — CID 7353332

IUPACN-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide
SMILESCC(=O)N(CCC[NH+]1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O2/c1-13(19)18(15-5-2-4-14(16)12-15)7-3-6-17-8-10-20-11-9-17/h2,4-5,12H,3,6-11H2,1H3/p+1
InChIKeyNTJIFSXMTBTURP-UHFFFAOYSA-O
MW297.81 g/mol
LogP1.00
Rot. Bonds5

About N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide

N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide (PubChem CID 7353332) has the molecular formula C15H22ClN2O2+ and a molecular weight of 297.81 g/mol. Its IUPAC name is N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide
PubChem CID7353332
Molecular FormulaC15H22ClN2O2+
Molecular Weight297.81 g/mol
Exact Mass297.14
IUPAC NameN-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide
SMILESCC(=O)N(CCC[NH+]1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O2/c1-13(19)18(15-5-2-4-14(16)12-15)7-3-6-17-8-10-20-11-9-17/h2,4-5,12H,3,6-11H2,1H3/p+1
InChIKeyNTJIFSXMTBTURP-UHFFFAOYSA-O
XLogP1.00
TPSA33.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.81
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-chlorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113127190
N-(3-chlorophenyl)-N-propylacetamide
CID 174491562
3-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 113127193
3-(N-acetyl-3-chloroanilino)-N-(2,6-dichlorophenyl)propanamide
CID 113127330
N-(3-chlorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113059569
4-[3-(3-chlorophenoxy)propyl]morpholin-4-ium chloride
CID 110175302
2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide
CID 113171303
3-chloro-N-(2-morpholin-4-ium-4-ylethyl)benzamide
CID 6919317
3-(N-acetyl-3-chloroanilino)-N-(3-methoxypropyl)propanamide
CID 113127189
N-(3-bromo-2-oxopropyl)-N-(3-chlorophenyl)acetamide
CID 104700865
N-[2-(N-acetyl-3-chloroanilino)ethyl]cyclobutanecarboxamide
CID 113059565
3-(N-acetyl-3-chloroanilino)-N-(2-methoxyethyl)propanamide
CID 113127188

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide?
The IUPAC name of N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide (CID 7353332) is N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide is CC(=O)N(CCC[NH+]1CCOCC1)c1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide?
The InChIKey is NTJIFSXMTBTURP-UHFFFAOYSA-O. The full InChI is InChI=1S/C15H21ClN2O2/c1-13(19)18(15-5-2-4-14(16)12-15)7-3-6-17-8-10-20-11-9-17/h2,4-5,12H,3,6-11H2,1H3/p+1.
What are the key properties of N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide?
N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide has a molecular weight of 297.81 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide is sourced from PubChem (CID 7353332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).