2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride

C14H25Cl2N3O — CID 119946092

IUPAC2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride
SMILESCN(C)CC(C)(C)CNC(=O)c1ccccc1N.Cl.Cl
InChIInChI=1S/C14H23N3O.2ClH/c1-14(2,10-17(3)4)9-16-13(18)11-7-5-6-8-12(11)15;;/h5-8H,9-10,15H2,1-4H3,(H,16,18);2*1H
InChIKeyCYNAUMNZEZNCAK-UHFFFAOYSA-N
MW322.28 g/mol
LogP2.43
Rot. Bonds5

About 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride

2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride (PubChem CID 119946092) has the molecular formula C14H25Cl2N3O and a molecular weight of 322.28 g/mol. Its IUPAC name is 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride
PubChem CID119946092
Molecular FormulaC14H25Cl2N3O
Molecular Weight322.28 g/mol
Exact Mass321.14
IUPAC Name2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride
SMILESCN(C)CC(C)(C)CNC(=O)c1ccccc1N.Cl.Cl
InChIInChI=1S/C14H23N3O.2ClH/c1-14(2,10-17(3)4)9-16-13(18)11-7-5-6-8-12(11)15;;/h5-8H,9-10,15H2,1-4H3,(H,16,18);2*1H
InChIKeyCYNAUMNZEZNCAK-UHFFFAOYSA-N
XLogP2.43
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.28
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride 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

2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]-3-fluorobenzamide
CID 62649866
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-nitrosobenzamide
CID 89135948
3-amino-2-chloro-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]benzamide
CID 106139493
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-hydrazinylpyridine-3-carboxamide
CID 62235756
3-[(2-aminobenzoyl)amino]-2-hydroxy-2-methylpropanoic acid
CID 66174920
2-N-(2-aminophenyl)-5-N-[3-(dimethylamino)-2,2-dimethylpropyl]thiophene-2,5-dicarboxamide
CID 10339400
2-chloro-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]benzamide
CID 103840160
5-amino-2,3-dichloro-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide
CID 107183328
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-3-fluorobenzamide
CID 62650035
7-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]-1H-indole-2-carboxamide
CID 63117459
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2,4-dimethylbenzamide
CID 70955109
3-amino-4-(dimethylamino)-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide
CID 61091598

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride?
The IUPAC name of 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride (CID 119946092) is 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride.
What is the SMILES notation for 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride?
The canonical SMILES for 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride is CN(C)CC(C)(C)CNC(=O)c1ccccc1N.Cl.Cl.
What is the InChIKey of 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride?
The InChIKey is CYNAUMNZEZNCAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O.2ClH/c1-14(2,10-17(3)4)9-16-13(18)11-7-5-6-8-12(11)15;;/h5-8H,9-10,15H2,1-4H3,(H,16,18);2*1H.
What are the key properties of 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride?
2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride has a molecular weight of 322.28 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]benzamide;dihydrochloride is sourced from PubChem (CID 119946092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).