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

C19H23FN8O — CID 166507500

IUPACN-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide
SMILESCNCC1(F)CCN(c2cnc(C(=O)Nc3cn4cc(C)nc4c(C)n3)cn2)C1
InChIInChI=1S/C19H23FN8O/c1-12-8-28-9-15(25-13(2)17(28)24-12)26-18(29)14-6-23-16(7-22-14)27-5-4-19(20,11-27)10-21-3/h6-9,21H,4-5,10-11H2,1-3H3,(H,26,29)
InChIKeyNCLGSCNPUMUISK-UHFFFAOYSA-N
MW398.45 g/mol
LogP1.53
Rot. Bonds5

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

N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide (PubChem CID 166507500) has the molecular formula C19H23FN8O and a molecular weight of 398.45 g/mol. Its IUPAC name is N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide
PubChem CID166507500
Molecular FormulaC19H23FN8O
Molecular Weight398.45 g/mol
Exact Mass398.20
IUPAC NameN-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide
SMILESCNCC1(F)CCN(c2cnc(C(=O)Nc3cn4cc(C)nc4c(C)n3)cn2)C1
InChIInChI=1S/C19H23FN8O/c1-12-8-28-9-15(25-13(2)17(28)24-12)26-18(29)14-6-23-16(7-22-14)27-5-4-19(20,11-27)10-21-3/h6-9,21H,4-5,10-11H2,1-3H3,(H,26,29)
InChIKeyNCLGSCNPUMUISK-UHFFFAOYSA-N
XLogP1.53
TPSA100.34 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.45
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

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
Imidazo[1,2-a]pyrazin-8-yl-[3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
CID 72121212
N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
CID 163518335
N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-3-[(3R)-3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazine-6-carboxamide
CID 166507910
N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
CID 166507966
1-(3-(1,7-dimethyl-2,4-dioxo-3,4-dihydro-1H-imidazo[2,1-f]purin-8(2H)-yl)propyl)piperidine-4-carboxamide
CID 16425843
N-propylimidazo[1,2-a]pyrazine-2-carboxamide
CID 53014543
N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide
CID 53014546
Imidazo[1,2-a]pyrazin-2-yl-(4-methylpiperidin-1-yl)methanone
CID 53014564
5-[(3R)-3-(cyclopropylamino)pyrrolidin-1-yl]-N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 172448798
5-[(3R)-3-(cyclopropylamino)pyrrolidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 172460642

Frequently Asked Questions

What is the IUPAC name of N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The IUPAC name of N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide (CID 166507500) is N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide is CNCC1(F)CCN(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-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The InChIKey is NCLGSCNPUMUISK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN8O/c1-12-8-28-9-15(25-13(2)17(28)24-12)26-18(29)14-6-23-16(7-22-14)27-5-4-19(20,11-27)10-21-3/h6-9,21H,4-5,10-11H2,1-3H3,(H,26,29).
What are the key properties of N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide?
N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide has a molecular weight of 398.45 g/mol, XLogP of 1.53, 5 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-[3-fluoro-3-(methylaminomethyl)pyrrolidin-1-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 166507500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).