2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide

C19H35N3O — CID 119850513

IUPAC2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide
SMILESCN(C)C(CNC(=O)CC1CC2CCC(C1)N2)C1CCCCC1
InChIInChI=1S/C19H35N3O/c1-22(2)18(15-6-4-3-5-7-15)13-20-19(23)12-14-10-16-8-9-17(11-14)21-16/h14-18,21H,3-13H2,1-2H3,(H,20,23)
InChIKeyLXUNHYYQGUIGQH-UHFFFAOYSA-N
MW321.51 g/mol
LogP2.53
Rot. Bonds6

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide (PubChem CID 119850513) has the molecular formula C19H35N3O and a molecular weight of 321.51 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide
PubChem CID119850513
Molecular FormulaC19H35N3O
Molecular Weight321.51 g/mol
Exact Mass321.28
IUPAC Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide
SMILESCN(C)C(CNC(=O)CC1CC2CCC(C1)N2)C1CCCCC1
InChIInChI=1S/C19H35N3O/c1-22(2)18(15-6-4-3-5-7-15)13-20-19(23)12-14-10-16-8-9-17(11-14)21-16/h14-18,21H,3-13H2,1-2H3,(H,20,23)
InChIKeyLXUNHYYQGUIGQH-UHFFFAOYSA-N
XLogP2.53
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.51
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]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

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2,2-dimethoxyethyl)acetamide
CID 79607693
N-[(2S)-2-cyclohexyl-2-(dimethylamino)ethyl]-2-methoxyacetamide
CID 94119176
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-cycloheptylacetamide
CID 79607418
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-cyanopropyl)acetamide
CID 79615389
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]acetamide;dihydrochloride
CID 119831119
3-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]-2-hydroxypropanamide
CID 106175674
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[[1-(dimethylamino)cyclobutyl]methyl]acetamide
CID 105417257
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-methoxy-3-methylbutyl)acetamide
CID 119813455
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[(2,2-dimethylcyclopropyl)methyl]acetamide
CID 113266851
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-methylsulfonylethyl)acetamide
CID 79606940
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-[cyclopropyl(methyl)amino]ethyl]acetamide;dihydrochloride
CID 119863867
N-[2-(8-azabicyclo[3.2.1]octan-3-ylamino)-2-oxoethyl]-2-cyclohexylacetamide;hydrochloride
CID 119456016

Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide?
The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide (CID 119850513) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide.
What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide?
The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide is CN(C)C(CNC(=O)CC1CC2CCC(C1)N2)C1CCCCC1.
What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide?
The InChIKey is LXUNHYYQGUIGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35N3O/c1-22(2)18(15-6-4-3-5-7-15)13-20-19(23)12-14-10-16-8-9-17(11-14)21-16/h14-18,21H,3-13H2,1-2H3,(H,20,23).
What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide?
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide has a molecular weight of 321.51 g/mol, XLogP of 2.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-cyclohexyl-2-(dimethylamino)ethyl]acetamide is sourced from PubChem (CID 119850513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).