5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide

C20H24N8O2 — CID 166848063

IUPAC5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
SMILESCOc1nc(NC(=O)c2cnc(N3CC(CNC4CC4)C3)cn2)cn2cc(C)nc12
InChIInChI=1S/C20H24N8O2/c1-12-8-28-11-16(26-20(30-2)18(28)24-12)25-19(29)15-6-23-17(7-22-15)27-9-13(10-27)5-21-14-3-4-14/h6-8,11,13-14,21H,3-5,9-10H2,1-2H3,(H,25,29)
InChIKeyFRDXMQNXDIPEFQ-UHFFFAOYSA-N
MW408.47 g/mol
LogP1.28
Rot. Bonds7

About 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide

5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide (PubChem CID 166848063) has the molecular formula C20H24N8O2 and a molecular weight of 408.47 g/mol. Its IUPAC name is 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
PubChem CID166848063
Molecular FormulaC20H24N8O2
Molecular Weight408.47 g/mol
Exact Mass408.20
IUPAC Name5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
SMILESCOc1nc(NC(=O)c2cnc(N3CC(CNC4CC4)C3)cn2)cn2cc(C)nc12
InChIInChI=1S/C20H24N8O2/c1-12-8-28-11-16(26-20(30-2)18(28)24-12)25-19(29)15-6-23-17(7-22-15)27-9-13(10-27)5-21-14-3-4-14/h6-8,11,13-14,21H,3-5,9-10H2,1-2H3,(H,25,29)
InChIKeyFRDXMQNXDIPEFQ-UHFFFAOYSA-N
XLogP1.28
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.47
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Related Compounds

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)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
CID 166507966
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
N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-[[(3S)-3-fluoropyrrolidin-1-yl]methyl]azetidin-1-yl]pyrazine-2-carboxamide
CID 166507441
5-[(3R,4S)-3-(ethylamino)-4-fluoropyrrolidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507470
5-[3-fluoro-3-(methylaminomethyl)azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507648
5-[3-[(3-fluoropyrrolidin-1-yl)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507707
5-[3-[(cyclopropylamino)methyl]-3-fluoropyrrolidin-1-yl]-N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507780
N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[3-[[(3R)-3-fluoropyrrolidin-1-yl]methyl]azetidin-1-yl]pyrazine-2-carboxamide
CID 166507814
5-[3-fluoro-3-(pyrrolidin-1-ylmethyl)azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507838
5-[(3S,4R)-3-(ethylamino)-4-fluoropyrrolidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507872

Frequently Asked Questions

What is the IUPAC name of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide (CID 166848063) is 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide is COc1nc(NC(=O)c2cnc(N3CC(CNC4CC4)C3)cn2)cn2cc(C)nc12.
What is the InChIKey of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
The InChIKey is FRDXMQNXDIPEFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N8O2/c1-12-8-28-11-16(26-20(30-2)18(28)24-12)25-19(29)15-6-23-17(7-22-15)27-9-13(10-27)5-21-14-3-4-14/h6-8,11,13-14,21H,3-5,9-10H2,1-2H3,(H,25,29).
What are the key properties of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide has a molecular weight of 408.47 g/mol, XLogP of 1.28, 7 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 166848063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).