1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine

C15H26N4O — CID 106559021

IUPAC1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCOCC(C)Nc1nc(C)cn1C1CN2CCC1CC2
InChIInChI=1S/C15H26N4O/c1-11-8-19(15(16-11)17-12(2)10-20-3)14-9-18-6-4-13(14)5-7-18/h8,12-14H,4-7,9-10H2,1-3H3,(H,16,17)
InChIKeyAZIHMFRGFQGLJS-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.91
Rot. Bonds5

About 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine

1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (PubChem CID 106559021) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
PubChem CID106559021
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCOCC(C)Nc1nc(C)cn1C1CN2CCC1CC2
InChIInChI=1S/C15H26N4O/c1-11-8-19(15(16-11)17-12(2)10-20-3)14-9-18-6-4-13(14)5-7-18/h8,12-14H,4-7,9-10H2,1-3H3,(H,16,17)
InChIKeyAZIHMFRGFQGLJS-UHFFFAOYSA-N
XLogP1.91
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine 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

N-(1-methoxypropan-2-yl)-4-methyl-1-(1-methylpiperidin-4-yl)imidazol-2-amine
CID 106561591
N-(1-methoxypropan-2-yl)-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106554828
N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methylmorpholin-2-yl)methyl]imidazol-2-amine
CID 106576057
1-[1-(dimethylamino)propan-2-yl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106578638
1-(2-methoxycyclopentyl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106569910
1-hexan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106569750
1-heptan-2-yl-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106568882
N-(1-methoxypropan-2-yl)-4-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine
CID 106566093
1-(4-chlorophenyl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106558500
1-(2,2-dimethylbutyl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106583486
4-methyl-1-(2-methylcyclopropyl)-N-propan-2-ylimidazol-2-amine
CID 106571168
N-(1-methoxypropan-2-yl)-4-methyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571808

Frequently Asked Questions

What is the IUPAC name of 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The IUPAC name of 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (CID 106559021) is 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.
What is the SMILES notation for 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The canonical SMILES for 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is COCC(C)Nc1nc(C)cn1C1CN2CCC1CC2.
What is the InChIKey of 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The InChIKey is AZIHMFRGFQGLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11-8-19(15(16-11)17-12(2)10-20-3)14-9-18-6-4-13(14)5-7-18/h8,12-14H,4-7,9-10H2,1-3H3,(H,16,17).
What are the key properties of 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine has a molecular weight of 278.40 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-azabicyclo[2.2.2]octan-3-yl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106559021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).