3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one

C21H18N6O — CID 167202737

IUPAC3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one
SMILESCc1cc2ccc(-c3cn(C)c(=O)c(Nc4ccc5[nH]ncc5c4)n3)cc2[nH]1
InChIInChI=1S/C21H18N6O/c1-12-7-13-3-4-14(9-18(13)23-12)19-11-27(2)21(28)20(25-19)24-16-5-6-17-15(8-16)10-22-26-17/h3-11,23H,1-2H3,(H,22,26)(H,24,25)
InChIKeyJESNZTGYOLWLGU-UHFFFAOYSA-N
MW370.42 g/mol
LogP3.86
Rot. Bonds3

About 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one

3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one (PubChem CID 167202737) has the molecular formula C21H18N6O and a molecular weight of 370.42 g/mol. Its IUPAC name is 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one.

Molecular Properties

Compound Name3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one
PubChem CID167202737
Molecular FormulaC21H18N6O
Molecular Weight370.42 g/mol
Exact Mass370.15
IUPAC Name3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one
SMILESCc1cc2ccc(-c3cn(C)c(=O)c(Nc4ccc5[nH]ncc5c4)n3)cc2[nH]1
InChIInChI=1S/C21H18N6O/c1-12-7-13-3-4-14(9-18(13)23-12)19-11-27(2)21(28)20(25-19)24-16-5-6-17-15(8-16)10-22-26-17/h3-11,23H,1-2H3,(H,22,26)(H,24,25)
InChIKeyJESNZTGYOLWLGU-UHFFFAOYSA-N
XLogP3.86
TPSA91.39 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.42
LogP ≤ 53.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-fluoro-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine
CID 166862856
N-[6-benzyl-2-(2-methyl-1H-indol-6-yl)pyrimidin-4-yl]-1H-indazol-5-amine
CID 146588316
6-[4-(1H-indazol-5-ylamino)quinazolin-2-yl]-1H-indole-2-carbaldehyde
CID 166920660
6-(3-aminophenyl)-N-(1H-indazol-5-yl)imidazo[1,2-a]pyrazin-8-amine
CID 57447602
N-[3-(1H-indazol-6-yl)pyrrolo[1,2-a]pyrazin-1-yl]-1,3-benzothiazol-5-amine
CID 70881672
6-[4-(1H-indazol-5-ylamino)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]-N-propan-2-yl-1H-indole-2-carboxamide
CID 137381903
2-(2-ethenyl-1H-indol-6-yl)-4-(1H-indazol-5-ylamino)pyrimidine-5-carbonitrile
CID 167203057
[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenyl]methanol
CID 59473100
N-[(1E,3Z)-1,4-diaminobuta-1,3-dien-2-yl]-6-[4-(1H-indazol-5-ylamino)-5,6-dimethylpyrimidin-2-yl]-1H-indole-2-carboxamide
CID 137381639
6-(1H-indazol-6-yl)-N-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473155
N-(4-fluorophenyl)-1H-indazol-5-amine
CID 91229030
N-(3-methyl-5-nitro-2-pyridinyl)-1H-indazol-5-amine
CID 133425970

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one?
The IUPAC name of 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one (CID 167202737) is 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one.
What is the SMILES notation for 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one?
The canonical SMILES for 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one is Cc1cc2ccc(-c3cn(C)c(=O)c(Nc4ccc5[nH]ncc5c4)n3)cc2[nH]1.
What is the InChIKey of 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one?
The InChIKey is JESNZTGYOLWLGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N6O/c1-12-7-13-3-4-14(9-18(13)23-12)19-11-27(2)21(28)20(25-19)24-16-5-6-17-15(8-16)10-22-26-17/h3-11,23H,1-2H3,(H,22,26)(H,24,25).
What are the key properties of 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one?
3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one has a molecular weight of 370.42 g/mol, XLogP of 3.86, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indazol-5-ylamino)-1-methyl-5-(2-methyl-1H-indol-6-yl)pyrazin-2-one is sourced from PubChem (CID 167202737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).