3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one

C12H12N4O2 — CID 14958935

IUPAC3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one
SMILESCOc1cccc2c(=O)c3c(N)[nH]nc3n(C)c12
InChIInChI=1S/C12H12N4O2/c1-16-9-6(4-3-5-7(9)18-2)10(17)8-11(13)14-15-12(8)16/h3-5H,1-2H3,(H3,13,14,15)
InChIKeyAKWXKXOIGHFTMY-UHFFFAOYSA-N
MW244.25 g/mol
LogP1.01
Rot. Bonds1

About 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one

3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one (PubChem CID 14958935) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one.

Molecular Properties

Compound Name3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one
PubChem CID14958935
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC Name3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one
SMILESCOc1cccc2c(=O)c3c(N)[nH]nc3n(C)c12
InChIInChI=1S/C12H12N4O2/c1-16-9-6(4-3-5-7(9)18-2)10(17)8-11(13)14-15-12(8)16/h3-5H,1-2H3,(H3,13,14,15)
InChIKeyAKWXKXOIGHFTMY-UHFFFAOYSA-N
XLogP1.01
TPSA85.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-chloro-7-methoxy-1-methylindol-2-yl)ethanone
CID 115042358
8-methoxy-9-methylpyrido[3,4-b]indol-1-amine
CID 115036068
5-methoxy-10-methyl-1,3-di(propan-2-yloxy)acridin-9-one
CID 11523258
3-(8-methoxy-1-methyl-2,4-dioxoquinazolin-3-yl)propanoic acid
CID 117263418
4,11-bis(2-methoxyphenyl)-5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
CID 138654549
3-(2-methoxyphenoxy)-4-methyl-1H-1,2,4-triazol-5-one
CID 67644966
4-amino-8-methoxy-1H-quinazolin-2-one
CID 25152155
7-methoxy-1,3-dimethylindole-2-carbaldehyde
CID 82491728
6,7-difluoro-1-methoxy-10-methylacridin-9-one
CID 102061435
9-cyclopropyl-8-methoxy-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 123690136
2-(4-amino-8-methoxypyrimido[4,5-b]indol-9-yl)acetic acid
CID 156877028
8-methoxy-1-methylquinolin-2-one
CID 742791

Frequently Asked Questions

What is the IUPAC name of 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one?
The IUPAC name of 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one (CID 14958935) is 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one.
What is the SMILES notation for 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one?
The canonical SMILES for 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one is COc1cccc2c(=O)c3c(N)[nH]nc3n(C)c12.
What is the InChIKey of 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one?
The InChIKey is AKWXKXOIGHFTMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c1-16-9-6(4-3-5-7(9)18-2)10(17)8-11(13)14-15-12(8)16/h3-5H,1-2H3,(H3,13,14,15).
What are the key properties of 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one?
3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one has a molecular weight of 244.25 g/mol, XLogP of 1.01, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-8-methoxy-9-methyl-2H-pyrazolo[3,4-b]quinolin-4-one is sourced from PubChem (CID 14958935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).