N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide

C18H20N6O2 — CID 128989377

IUPACN-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCn1ccnc(N2CCCC(NC(=O)c3cnc4ccccn34)C2)c1=O
InChIInChI=1S/C18H20N6O2/c1-22-10-7-19-16(18(22)26)23-8-4-5-13(12-23)21-17(25)14-11-20-15-6-2-3-9-24(14)15/h2-3,6-7,9-11,13H,4-5,8,12H2,1H3,(H,21,25)
InChIKeyBFGUELGONTZSPQ-UHFFFAOYSA-N
MW352.40 g/mol
LogP0.83
Rot. Bonds3

About N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide

N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 128989377) has the molecular formula C18H20N6O2 and a molecular weight of 352.40 g/mol. Its IUPAC name is N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID128989377
Molecular FormulaC18H20N6O2
Molecular Weight352.40 g/mol
Exact Mass352.16
IUPAC NameN-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCn1ccnc(N2CCCC(NC(=O)c3cnc4ccccn34)C2)c1=O
InChIInChI=1S/C18H20N6O2/c1-22-10-7-19-16(18(22)26)23-8-4-5-13(12-23)21-17(25)14-11-20-15-6-2-3-9-24(14)15/h2-3,6-7,9-11,13H,4-5,8,12H2,1H3,(H,21,25)
InChIKeyBFGUELGONTZSPQ-UHFFFAOYSA-N
XLogP0.83
TPSA84.53 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide (CID 128989377) is N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide is Cn1ccnc(N2CCCC(NC(=O)c3cnc4ccccn34)C2)c1=O.
What is the InChIKey of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is BFGUELGONTZSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2/c1-22-10-7-19-16(18(22)26)23-8-4-5-13(12-23)21-17(25)14-11-20-15-6-2-3-9-24(14)15/h2-3,6-7,9-11,13H,4-5,8,12H2,1H3,(H,21,25).
What are the key properties of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide?
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 352.40 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 128989377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).