2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride

C18H31Cl2N3O — CID 119850460

IUPAC2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride
SMILESCN(C)C(CNC(=O)C(N)c1ccccc1)C1CCCCC1.Cl.Cl
InChIInChI=1S/C18H29N3O.2ClH/c1-21(2)16(14-9-5-3-6-10-14)13-20-18(22)17(19)15-11-7-4-8-12-15;;/h4,7-8,11-12,14,16-17H,3,5-6,9-10,13,19H2,1-2H3,(H,20,22);2*1H
InChIKeyAIGUWUQUNYHMNG-UHFFFAOYSA-N
MW376.37 g/mol
LogP3.16
Rot. Bonds6

About 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride

2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride (PubChem CID 119850460) has the molecular formula C18H31Cl2N3O and a molecular weight of 376.37 g/mol. Its IUPAC name is 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride
PubChem CID119850460
Molecular FormulaC18H31Cl2N3O
Molecular Weight376.37 g/mol
Exact Mass375.18
IUPAC Name2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride
SMILESCN(C)C(CNC(=O)C(N)c1ccccc1)C1CCCCC1.Cl.Cl
InChIInChI=1S/C18H29N3O.2ClH/c1-21(2)16(14-9-5-3-6-10-14)13-20-18(22)17(19)15-11-7-4-8-12-15;;/h4,7-8,11-12,14,16-17H,3,5-6,9-10,13,19H2,1-2H3,(H,20,22);2*1H
InChIKeyAIGUWUQUNYHMNG-UHFFFAOYSA-N
XLogP3.16
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.37
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;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

(2R)-2-amino-N-[(1R)-1-cycloheptylethyl]-2-phenylacetamide
CID 81393222
(2S)-2-amino-N-[(1R)-1-cycloheptylethyl]-2-phenylacetamide
CID 104898224
(2R)-2-amino-N-[(1R)-1-cyclohexylethyl]-2-phenylacetamide
CID 81385705
(2S)-2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-3-methylbutanamide
CID 119850509
(2R)-2-amino-N-[2-(dimethylamino)propyl]-2-phenylacetamide
CID 61156707
2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]pentanamide;dihydrochloride
CID 119850478
2-amino-N-(2-cyclopentylethyl)-2-phenylacetamide;hydrochloride
CID 119289820
(2R)-2-amino-N-cycloheptyl-2-phenylacetamide
CID 61148121
2-amino-N-(2-cycloheptyloxyethyl)-2-phenylacetamide;hydrochloride
CID 119325370
(2S)-2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-4-methylsulfanylbutanamide;dihydrochloride
CID 119850474
2-amino-N-[2-(dimethylamino)ethyl]-2-phenylacetamide;hydrochloride
CID 120994237
(2R)-2-amino-N-[(2S)-2-hydroxypropyl]-2-phenylacetamide
CID 93083385

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride?
The IUPAC name of 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride (CID 119850460) is 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride.
What is the SMILES notation for 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride?
The canonical SMILES for 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride is CN(C)C(CNC(=O)C(N)c1ccccc1)C1CCCCC1.Cl.Cl.
What is the InChIKey of 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride?
The InChIKey is AIGUWUQUNYHMNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O.2ClH/c1-21(2)16(14-9-5-3-6-10-14)13-20-18(22)17(19)15-11-7-4-8-12-15;;/h4,7-8,11-12,14,16-17H,3,5-6,9-10,13,19H2,1-2H3,(H,20,22);2*1H.
What are the key properties of 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride?
2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride has a molecular weight of 376.37 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-cyclohexyl-2-(dimethylamino)ethyl]-2-phenylacetamide;dihydrochloride is sourced from PubChem (CID 119850460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).