N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide

C13H19Cl2N3O — CID 62642488

IUPACN-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide
SMILESCCN(C)CCNCC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C13H19Cl2N3O/c1-3-18(2)8-7-16-9-12(19)17-13-10(14)5-4-6-11(13)15/h4-6,16H,3,7-9H2,1-2H3,(H,17,19)
InChIKeyDDLKFAUQRDDMMO-UHFFFAOYSA-N
MW304.22 g/mol
LogP2.47
Rot. Bonds7

About N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide

N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide (PubChem CID 62642488) has the molecular formula C13H19Cl2N3O and a molecular weight of 304.22 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide
PubChem CID62642488
Molecular FormulaC13H19Cl2N3O
Molecular Weight304.22 g/mol
Exact Mass303.09
IUPAC NameN-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide
SMILESCCN(C)CCNCC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C13H19Cl2N3O/c1-3-18(2)8-7-16-9-12(19)17-13-10(14)5-4-6-11(13)15/h4-6,16H,3,7-9H2,1-2H3,(H,17,19)
InChIKeyDDLKFAUQRDDMMO-UHFFFAOYSA-N
XLogP2.47
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.22
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-chlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide
CID 62640663
N-(2,6-dichlorophenyl)-2-(3-hydroxypropylamino)acetamide
CID 43405278
3-[[2-(2,6-dichloroanilino)-2-oxoethyl]amino]propanamide
CID 43627349
N-(2,6-dichlorophenyl)-2-(dimethylamino)acetamide
CID 9255062
ethyl 3-[[2-(2,6-dichloroanilino)-2-oxoethyl]-methylamino]propanoate
CID 60704458
N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide
CID 106160091
N-(2-chlorophenyl)-2-[2-[2-methoxyethyl(methyl)amino]ethylamino]acetamide
CID 62843980
N'-(2,6-dichlorophenyl)-N-propylpropanediamide
CID 108940761
2-(2-cyclopentylethylamino)-N-(2,6-dichlorophenyl)acetamide
CID 60919366
2-[(2-chlorophenyl)methylamino]-N-(2,6-dichlorophenyl)acetamide
CID 43405213
N-[2-(2,6-dichloroanilino)-2-oxoethyl]butanamide
CID 113001397
N-(2,6-dichlorophenyl)-2-[3-hydroxypropyl(methyl)amino]acetamide
CID 51225789

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide (CID 62642488) is N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide is CCN(C)CCNCC(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide?
The InChIKey is DDLKFAUQRDDMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19Cl2N3O/c1-3-18(2)8-7-16-9-12(19)17-13-10(14)5-4-6-11(13)15/h4-6,16H,3,7-9H2,1-2H3,(H,17,19).
What are the key properties of N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide?
N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide has a molecular weight of 304.22 g/mol, XLogP of 2.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide is sourced from PubChem (CID 62642488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).