N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide

C20H23N9O — CID 170380616

IUPACN-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide
SMILESCc1cn2nc(NC(=O)c3ccc(N4CCNCC4)c4nn(C)cc34)nc2c(C)n1
InChIInChI=1S/C20H23N9O/c1-12-10-29-18(13(2)22-12)23-20(26-29)24-19(30)14-4-5-16(28-8-6-21-7-9-28)17-15(14)11-27(3)25-17/h4-5,10-11,21H,6-9H2,1-3H3,(H,24,26,30)
InChIKeyCFFYIFTUDFOEBY-UHFFFAOYSA-N
MW405.47 g/mol
LogP1.29
Rot. Bonds3

About N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide

N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide (PubChem CID 170380616) has the molecular formula C20H23N9O and a molecular weight of 405.47 g/mol. Its IUPAC name is N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide.

Molecular Properties

Compound NameN-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide
PubChem CID170380616
Molecular FormulaC20H23N9O
Molecular Weight405.47 g/mol
Exact Mass405.20
IUPAC NameN-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide
SMILESCc1cn2nc(NC(=O)c3ccc(N4CCNCC4)c4nn(C)cc34)nc2c(C)n1
InChIInChI=1S/C20H23N9O/c1-12-10-29-18(13(2)22-12)23-20(26-29)24-19(30)14-4-5-16(28-8-6-21-7-9-28)17-15(14)11-27(3)25-17/h4-5,10-11,21H,6-9H2,1-3H3,(H,24,26,30)
InChIKeyCFFYIFTUDFOEBY-UHFFFAOYSA-N
XLogP1.29
TPSA105.27 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.47
LogP ≤ 51.29
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)-2-methyl-4-piperazin-1-ylindazole-7-carboxamide
CID 167501050
N-(4-hydroxy-2,7-dimethylindazol-5-yl)-2-methyl-4-piperazin-1-ylindazole-7-carboxamide
CID 167501120
N-(7-acetyl-2-methylimidazo[1,2-a]pyridin-6-yl)-2-methyl-4-piperazin-1-ylindazole-7-carboxamide
CID 167501576
2-methyl-N-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-piperazin-1-ylindazole-7-carboxamide
CID 167501947
N-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-5-piperazin-1-ylcinnoline-8-carboxamide
CID 166558395
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-methyl-4-[(3R)-3-piperazin-1-ylpyrrolidin-1-yl]indazole-7-carboxamide
CID 167501070
N-(8-chloro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-methyl-4-(3-methylpiperazin-1-yl)indazole-7-carboxamide
CID 166523450
N-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-4-piperazin-1-ylcinnoline-8-carboxamide
CID 171717340
N-(8-chloro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-piperazin-1-ylcinnoline-8-carboxamide
CID 166522206
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-piperazin-1-yl-2H-benzotriazole-4-carboxamide
CID 167501514
ethyl N-(8-piperazin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)carbamate
CID 110455453
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-piperazin-1-yl-2-propylindazole-7-carboxamide
CID 167500977

Frequently Asked Questions

What is the IUPAC name of N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide?
The IUPAC name of N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide (CID 170380616) is N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide.
What is the SMILES notation for N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide?
The canonical SMILES for N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide is Cc1cn2nc(NC(=O)c3ccc(N4CCNCC4)c4nn(C)cc34)nc2c(C)n1.
What is the InChIKey of N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide?
The InChIKey is CFFYIFTUDFOEBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N9O/c1-12-10-29-18(13(2)22-12)23-20(26-29)24-19(30)14-4-5-16(28-8-6-21-7-9-28)17-15(14)11-27(3)25-17/h4-5,10-11,21H,6-9H2,1-3H3,(H,24,26,30).
What are the key properties of N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide?
N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide has a molecular weight of 405.47 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)-2-methyl-7-piperazin-1-ylindazole-4-carboxamide is sourced from PubChem (CID 170380616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).