N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide

C18H22N8O — CID 166507966

IUPACN-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
SMILESCN[C@@H]1CCN(c2cnc(C(=O)Nc3cn4cc(C)nc4c(C)n3)cn2)C1
InChIInChI=1S/C18H22N8O/c1-11-8-26-10-15(23-12(2)17(26)22-11)24-18(27)14-6-21-16(7-20-14)25-5-4-13(9-25)19-3/h6-8,10,13,19H,4-5,9H2,1-3H3,(H,24,27)/t13-/m1/s1
InChIKeyAXWCVVVJXQIQNH-CYBMUJFWSA-N
MW366.43 g/mol
LogP1.19
Rot. Bonds4

About N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide

N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide (PubChem CID 166507966) has the molecular formula C18H22N8O and a molecular weight of 366.43 g/mol. Its IUPAC name is N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
PubChem CID166507966
Molecular FormulaC18H22N8O
Molecular Weight366.43 g/mol
Exact Mass366.19
IUPAC NameN-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
SMILESCN[C@@H]1CCN(c2cnc(C(=O)Nc3cn4cc(C)nc4c(C)n3)cn2)C1
InChIInChI=1S/C18H22N8O/c1-11-8-26-10-15(23-12(2)17(26)22-11)24-18(27)14-6-21-16(7-20-14)25-5-4-13(9-25)19-3/h6-8,10,13,19H,4-5,9H2,1-3H3,(H,24,27)/t13-/m1/s1
InChIKeyAXWCVVVJXQIQNH-CYBMUJFWSA-N
XLogP1.19
TPSA100.34 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

2-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-N,1-dimethylimidazole-4-carboxamide
CID 165415160
(E)-8-((3-(1H-imidazol-1-yl)propyl)amino)-7-(3-chlorobut-2-en-1-yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
CID 5389846
N-tert-butyl-8-(4-pyrimidin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyrazine-6-carboxamide
CID 44415532
8-(3-imidazol-1-ylpropyl)-1,3-dimethyl-7,9-dihydro-6H-purino[7,8-a]pyrazine-2,4-dione
CID 155540193
9-ethyl-4-(2-ethylimidazol-1-yl)-5H-imidazo[5,1-h]pteridin-6-one
CID 15076579
6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)imidazo[1,2-a]pyrimidine-2-carboxamide
CID 56751513
Imidazo[1,2-a]pyrazin-2-yl-(4-methylpiperazin-1-yl)methanone
CID 57397738
Imidazo[1,2-a]pyrazin-8-yl-[3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
CID 72121212
2-methyl-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-1H-imidazole-5-carboxamide
CID 72137120
Imidazo[1,2-a]pyrimidin-2-yl-[3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]methanone
CID 72143150
[3-(2-Ethylimidazol-1-yl)piperidin-1-yl]-imidazo[1,2-a]pyrimidin-2-ylmethanone
CID 72143175
[2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone
CID 97467328

Frequently Asked Questions

What is the IUPAC name of N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The IUPAC name of N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide (CID 166507966) is N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide is CN[C@@H]1CCN(c2cnc(C(=O)Nc3cn4cc(C)nc4c(C)n3)cn2)C1.
What is the InChIKey of N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The InChIKey is AXWCVVVJXQIQNH-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H22N8O/c1-11-8-26-10-15(23-12(2)17(26)22-11)24-18(27)14-6-21-16(7-20-14)25-5-4-13(9-25)19-3/h6-8,10,13,19H,4-5,9H2,1-3H3,(H,24,27)/t13-/m1/s1.
What are the key properties of N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide has a molecular weight of 366.43 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 166507966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).