imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone

C15H18N4O — CID 171945511

IUPACimidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
SMILESCN1C2CCC1CC(C(=O)c1cnc3ncccn13)C2
InChIInChI=1S/C15H18N4O/c1-18-11-3-4-12(18)8-10(7-11)14(20)13-9-17-15-16-5-2-6-19(13)15/h2,5-6,9-12H,3-4,7-8H2,1H3
InChIKeyQOUIGOAPVITLRQ-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.78
Rot. Bonds2

About imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone

imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone (PubChem CID 171945511) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone.

Molecular Properties

Compound Nameimidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
PubChem CID171945511
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Nameimidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
SMILESCN1C2CCC1CC(C(=O)c1cnc3ncccn13)C2
InChIInChI=1S/C15H18N4O/c1-18-11-3-4-12(18)8-10(7-11)14(20)13-9-17-15-16-5-2-6-19(13)15/h2,5-6,9-12H,3-4,7-8H2,1H3
InChIKeyQOUIGOAPVITLRQ-UHFFFAOYSA-N
XLogP1.78
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone with MolForge

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Related Compounds

1-Imidazo[1,2-a]pyrimidin-2-yl-2-methylpropan-1-one
CID 68042772
1-(2-Ethylimidazo[1,2-a]pyrimidin-3-yl)-2-methylpropan-1-one
CID 118564455
3-Methyl-1-(2-methylimidazo[1,2-a]pyrimidin-3-yl)hexan-1-one
CID 123691127
1-Imidazo[1,2-a]pyrimidin-3-yl-2-methylpropan-1-one
CID 134572835
1-Imidazo[1,2-a]pyrimidin-3-yl-2-methylbutan-1-one
CID 135193956
1-(2-Ethylimidazo[1,2-a]pyrimidin-3-yl)-2-methylbutan-1-one
CID 144672681
2-Butyl-1-imidazo[1,2-a]pyrimidin-3-ylhexan-1-one
CID 154612485
2-Ethyl-1-imidazo[1,2-a]pyrimidin-3-ylbutan-1-one
CID 166942027
1-Imidazo[1,2-a]pyrimidin-3-yl-2,2-dimethylpropan-1-one
CID 168764346
8-Azabicyclo[3.2.1]octan-3-yl(imidazo[1,2-a]pyrimidin-3-yl)methanone
CID 171945510
Tert-butyl 3-(imidazo[1,2-a]pyrimidine-3-carbonyl)-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 171945512
(8-Benzyl-8-azabicyclo[3.2.1]octan-3-yl)-imidazo[1,2-a]pyrimidin-3-ylmethanone
CID 171945515

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The IUPAC name of imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone (CID 171945511) is imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone.
What is the SMILES notation for imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The canonical SMILES for imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone is CN1C2CCC1CC(C(=O)c1cnc3ncccn13)C2.
What is the InChIKey of imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The InChIKey is QOUIGOAPVITLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-18-11-3-4-12(18)8-10(7-11)14(20)13-9-17-15-16-5-2-6-19(13)15/h2,5-6,9-12H,3-4,7-8H2,1H3.
What are the key properties of imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone has a molecular weight of 270.34 g/mol, XLogP of 1.78, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyrimidin-3-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone is sourced from PubChem (CID 171945511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).