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

C18H22N8O2 — CID 163518335

IUPACN-(8-methoxy-2-methylimidazo[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(OC)n3)cn2)C1
InChIInChI=1S/C18H22N8O2/c1-11-8-26-10-14(24-18(28-3)16(26)22-11)23-17(27)13-6-21-15(7-20-13)25-5-4-12(9-25)19-2/h6-8,10,12,19H,4-5,9H2,1-3H3,(H,23,27)/t12-/m1/s1
InChIKeyDIQXTIPARDWZPC-GFCCVEGCSA-N
MW382.43 g/mol
LogP0.89
Rot. Bonds5

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

N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide (PubChem CID 163518335) has the molecular formula C18H22N8O2 and a molecular weight of 382.43 g/mol. Its IUPAC name is N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
PubChem CID163518335
Molecular FormulaC18H22N8O2
Molecular Weight382.43 g/mol
Exact Mass382.19
IUPAC NameN-(8-methoxy-2-methylimidazo[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(OC)n3)cn2)C1
InChIInChI=1S/C18H22N8O2/c1-11-8-26-10-14(24-18(28-3)16(26)22-11)23-17(27)13-6-21-15(7-20-13)25-5-4-12(9-25)19-2/h6-8,10,12,19H,4-5,9H2,1-3H3,(H,23,27)/t12-/m1/s1
InChIKeyDIQXTIPARDWZPC-GFCCVEGCSA-N
XLogP0.89
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.43
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The IUPAC name of N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide (CID 163518335) is N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-(8-methoxy-2-methylimidazo[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(OC)n3)cn2)C1.
What is the InChIKey of N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
The InChIKey is DIQXTIPARDWZPC-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H22N8O2/c1-11-8-26-10-14(24-18(28-3)16(26)22-11)23-17(27)13-6-21-15(7-20-13)25-5-4-12(9-25)19-2/h6-8,10,12,19H,4-5,9H2,1-3H3,(H,23,27)/t12-/m1/s1.
What are the key properties of N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide?
N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide has a molecular weight of 382.43 g/mol, XLogP of 0.89, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 163518335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).