2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide

C15H23Cl2N3O — CID 79664777

IUPAC2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide
SMILESCCN(CC(=O)Nc1cc(Cl)ccc1Cl)CC(C)(C)CN
InChIInChI=1S/C15H23Cl2N3O/c1-4-20(10-15(2,3)9-18)8-14(21)19-13-7-11(16)5-6-12(13)17/h5-7H,4,8-10,18H2,1-3H3,(H,19,21)
InChIKeyWQVKXKRBTXCXSM-UHFFFAOYSA-N
MW332.28 g/mol
LogP3.24
Rot. Bonds7

About 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide

2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide (PubChem CID 79664777) has the molecular formula C15H23Cl2N3O and a molecular weight of 332.28 g/mol. Its IUPAC name is 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide
PubChem CID79664777
Molecular FormulaC15H23Cl2N3O
Molecular Weight332.28 g/mol
Exact Mass331.12
IUPAC Name2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide
SMILESCCN(CC(=O)Nc1cc(Cl)ccc1Cl)CC(C)(C)CN
InChIInChI=1S/C15H23Cl2N3O/c1-4-20(10-15(2,3)9-18)8-14(21)19-13-7-11(16)5-6-12(13)17/h5-7H,4,8-10,18H2,1-3H3,(H,19,21)
InChIKeyWQVKXKRBTXCXSM-UHFFFAOYSA-N
XLogP3.24
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.28
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)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

3-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2-chlorophenyl)propanamide
CID 79664559
N-(2-chlorophenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 78962251
2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2-cyanophenyl)acetamide
CID 79664547
2-[[3-(2,5-dichloroanilino)-3-oxopropyl]-ethylamino]acetic acid
CID 61012162
2-[[2-(2,5-dichloroanilino)-2-oxoethyl]-ethylamino]-N-[(4-fluorophenyl)methyl]acetamide
CID 2522121
2-[[2-(2,5-dichloroanilino)-2-oxoethyl]-methylamino]-2-methylpropanoic acid
CID 62820409
N-(4-amino-2-chlorophenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 79384076
2-[[2-(2-amino-5-chloroanilino)-2-oxoethyl]-ethylamino]acetamide
CID 103101401
2-[[2-(5-amino-2-chloroanilino)-2-oxoethyl]-ethylamino]acetamide
CID 103101383
4-[[2-[[2-(2,5-dichloroanilino)-2-oxoethyl]-propylamino]acetyl]amino]benzamide
CID 2541352
N-(4-chloro-2-methylphenyl)-2-(diethylamino)acetamide;hydrochloride
CID 131885103
2-(diethylamino)ethyl N-(2,5-dichlorophenyl)carbamate
CID 30027

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide?
The IUPAC name of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide (CID 79664777) is 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide is CCN(CC(=O)Nc1cc(Cl)ccc1Cl)CC(C)(C)CN.
What is the InChIKey of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide?
The InChIKey is WQVKXKRBTXCXSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23Cl2N3O/c1-4-20(10-15(2,3)9-18)8-14(21)19-13-7-11(16)5-6-12(13)17/h5-7H,4,8-10,18H2,1-3H3,(H,19,21).
What are the key properties of 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide?
2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide has a molecular weight of 332.28 g/mol, XLogP of 3.24, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2,5-dichlorophenyl)acetamide is sourced from PubChem (CID 79664777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).