2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide

C16H31N3O — CID 61232221

IUPAC2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(C)C1CC2CCC(C1)N2
InChIInChI=1S/C16H31N3O/c1-4-8-19(9-5-2)16(20)12-18(3)15-10-13-6-7-14(11-15)17-13/h13-15,17H,4-12H2,1-3H3
InChIKeyFVADFDITGGZXOG-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.85
Rot. Bonds7

About 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide

2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide (PubChem CID 61232221) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide
PubChem CID61232221
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(C)C1CC2CCC(C1)N2
InChIInChI=1S/C16H31N3O/c1-4-8-19(9-5-2)16(20)12-18(3)15-10-13-6-7-14(11-15)17-13/h13-15,17H,4-12H2,1-3H3
InChIKeyFVADFDITGGZXOG-UHFFFAOYSA-N
XLogP1.85
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide 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

(1R,5S)-N-methyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 26189078
2-[methyl-[4-(methylamino)cyclohexyl]amino]-N,N-dipropylacetamide
CID 79110170
tert-butyl 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetate
CID 61232424
propan-2-yl 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetate
CID 61231285
N'-acetyl-2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]acetohydrazide
CID 61233382
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylpentanamide
CID 61232017
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-1-(azocan-1-yl)ethanone
CID 61232607
1-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-3-ethoxypropan-2-ol
CID 63933610
2-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]-N-ethyl-N-methylacetamide
CID 61230973
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(cyclopropylmethyl)-N-propylacetamide;hydrochloride
CID 119676711
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-(1,1-dioxothiolan-3-yl)acetamide
CID 61232030
ethyl 2-[8-azabicyclo[3.2.1]octan-3-yl(propyl)sulfamoyl]acetate
CID 61457503

Frequently Asked Questions

What is the IUPAC name of 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide?
The IUPAC name of 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide (CID 61232221) is 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide?
The canonical SMILES for 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide is CCCN(CCC)C(=O)CN(C)C1CC2CCC(C1)N2.
What is the InChIKey of 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide?
The InChIKey is FVADFDITGGZXOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-4-8-19(9-5-2)16(20)12-18(3)15-10-13-6-7-14(11-15)17-13/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide?
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N,N-dipropylacetamide has a molecular weight of 281.44 g/mol, XLogP of 1.85, 7 rotatable bonds, 1 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(methyl)amino]-N,N-dipropylacetamide is sourced from PubChem (CID 61232221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).