N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide

C21H22N8O — CID 166558395

IUPACN-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide
SMILESCc1cn2cc(NC(=O)c3ccc(N4CCNCC4)c4ccnnc34)nc2c(C)n1
InChIInChI=1S/C21H22N8O/c1-13-11-29-12-18(25-20(29)14(2)24-13)26-21(30)16-3-4-17(28-9-7-22-8-10-28)15-5-6-23-27-19(15)16/h3-6,11-12,22H,7-10H2,1-2H3,(H,26,30)
InChIKeyXJLZENYQPMYGOY-UHFFFAOYSA-N
MW402.46 g/mol
LogP1.95
Rot. Bonds3

About N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide

N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide (PubChem CID 166558395) has the molecular formula C21H22N8O and a molecular weight of 402.46 g/mol. Its IUPAC name is N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide.

Molecular Properties

Compound NameN-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide
PubChem CID166558395
Molecular FormulaC21H22N8O
Molecular Weight402.46 g/mol
Exact Mass402.19
IUPAC NameN-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide
SMILESCc1cn2cc(NC(=O)c3ccc(N4CCNCC4)c4ccnnc34)nc2c(C)n1
InChIInChI=1S/C21H22N8O/c1-13-11-29-12-18(25-20(29)14(2)24-13)26-21(30)16-3-4-17(28-9-7-22-8-10-28)15-5-6-23-27-19(15)16/h3-6,11-12,22H,7-10H2,1-2H3,(H,26,30)
InChIKeyXJLZENYQPMYGOY-UHFFFAOYSA-N
XLogP1.95
TPSA100.34 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.46
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

N-(8-chloro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperazin-1-ylcinnoline-8-carboxamide
CID 166522206
N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)-2-methyl-4-piperazin-1-ylindazole-7-carboxamide
CID 167501050
N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-8-[(3S,5R)-3,5-dimethylpiperazin-1-yl]quinoxaline-5-carboxamide
CID 167500526
tert-butyl 4-[8-[(8-acetyl-2-methylimidazo[1,2-a]pyridin-6-yl)carbamoyl]cinnolin-5-yl]piperazine-1-carboxylate
CID 167500169
tert-butyl 4-[8-[(4,6-dimethylpyrazolo[1,5-a]pyrazin-2-yl)carbamoyl]cinnolin-5-yl]piperazine-1-carboxylate
CID 166522143
N-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-4-piperazin-1-ylcinnoline-8-carboxamide
CID 171717340
N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-2-fluoro-4-[(3R)-3-methylpiperazin-1-yl]benzamide
CID 155483868
2-ethyl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-piperazin-1-ylindazole-7-carboxamide;propane
CID 167500912
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-piperazin-1-yl-2H-benzotriazole-4-carboxamide
CID 167501514
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-piperazin-1-yl-2-propylindazole-7-carboxamide
CID 167500977
N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide
CID 170380616
tert-butyl (2R,6S)-4-[8-[(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)carbamoyl]cinnolin-5-yl]-2,6-dimethylpiperazine-1-carboxylate
CID 167500543

Frequently Asked Questions

What is the IUPAC name of N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide?
The IUPAC name of N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide (CID 166558395) is N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide.
What is the SMILES notation for N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide?
The canonical SMILES for N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide is Cc1cn2cc(NC(=O)c3ccc(N4CCNCC4)c4ccnnc34)nc2c(C)n1.
What is the InChIKey of N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide?
The InChIKey is XJLZENYQPMYGOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N8O/c1-13-11-29-12-18(25-20(29)14(2)24-13)26-21(30)16-3-4-17(28-9-7-22-8-10-28)15-5-6-23-27-19(15)16/h3-6,11-12,22H,7-10H2,1-2H3,(H,26,30).
What are the key properties of N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide?
N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide has a molecular weight of 402.46 g/mol, XLogP of 1.95, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide is sourced from PubChem (CID 166558395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).