2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide

C14H19Cl2N2O2+ — CID 2634680

IUPAC2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NCC[NH+]1CCOCC1
InChIInChI=1S/C14H18Cl2N2O2/c15-12-2-1-11(13(16)10-12)9-14(19)17-3-4-18-5-7-20-8-6-18/h1-2,10H,3-9H2,(H,17,19)/p+1
InChIKeyMIXUATSUYARKGM-UHFFFAOYSA-O
MW318.22 g/mol
LogP0.57
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide

2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide (PubChem CID 2634680) has the molecular formula C14H19Cl2N2O2+ and a molecular weight of 318.22 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide
PubChem CID2634680
Molecular FormulaC14H19Cl2N2O2+
Molecular Weight318.22 g/mol
Exact Mass317.08
IUPAC Name2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NCC[NH+]1CCOCC1
InChIInChI=1S/C14H18Cl2N2O2/c15-12-2-1-11(13(16)10-12)9-14(19)17-3-4-18-5-7-20-8-6-18/h1-2,10H,3-9H2,(H,17,19)/p+1
InChIKeyMIXUATSUYARKGM-UHFFFAOYSA-O
XLogP0.57
TPSA42.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.22
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2,4-dichlorophenyl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
CID 8669408
2-(2,4-dichloro-N-methylsulfonylanilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide
CID 7339596
3-chloro-N-(2-morpholin-4-ium-4-ylethyl)benzamide
CID 6919317
2-chloro-4-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzamide
CID 7286130
N-[2-(4-chlorophenyl)ethyl]-2-(2,4-dichlorophenyl)acetamide
CID 9217667
N-[(4-chlorophenyl)methyl]-2-(2,4-dichlorophenyl)acetamide
CID 1226021
1-[(Z)-(2,4-dichlorophenyl)methylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea
CID 7934130
N-[(2,4-dichlorophenyl)methylideneamino]-3-morpholin-4-ium-4-ylpropanamide
CID 4744533
2-(4-hydroxy-3-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide
CID 71598518
N-[2-[[2-(2,4-dichlorophenyl)acetyl]amino]ethyl]-4-hydroxybenzamide
CID 47038490
N-(2-morpholin-4-ium-4-ylethyl)-3,3-diphenylpropanamide
CID 6919320
(2S)-2-(2,4-dichlorophenoxy)-N-(3-morpholin-4-ium-4-ylpropyl)propanamide
CID 7160349

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide (CID 2634680) is 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide is O=C(Cc1ccc(Cl)cc1Cl)NCC[NH+]1CCOCC1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide?
The InChIKey is MIXUATSUYARKGM-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H18Cl2N2O2/c15-12-2-1-11(13(16)10-12)9-14(19)17-3-4-18-5-7-20-8-6-18/h1-2,10H,3-9H2,(H,17,19)/p+1.
What are the key properties of 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide?
2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide has a molecular weight of 318.22 g/mol, XLogP of 0.57, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide is sourced from PubChem (CID 2634680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).