7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one

C18H15N3O2 — CID 58034296

IUPAC7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one
SMILESCOc1cccc(C2=Cc3cnc4cc(C)nn4c3CC2=O)c1
InChIInChI=1S/C18H15N3O2/c1-11-6-18-19-10-13-8-15(12-4-3-5-14(7-12)23-2)17(22)9-16(13)21(18)20-11/h3-8,10H,9H2,1-2H3
InChIKeyNMQRWUFTGZEYQI-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.71
Rot. Bonds2

About 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one

7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one (PubChem CID 58034296) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one.

Molecular Properties

Compound Name7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one
PubChem CID58034296
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one
SMILESCOc1cccc(C2=Cc3cnc4cc(C)nn4c3CC2=O)c1
InChIInChI=1S/C18H15N3O2/c1-11-6-18-19-10-13-8-15(12-4-3-5-14(7-12)23-2)17(22)9-16(13)21(18)20-11/h3-8,10H,9H2,1-2H3
InChIKeyNMQRWUFTGZEYQI-UHFFFAOYSA-N
XLogP2.71
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

11-(3-methoxyphenyl)sulfonyl-4-methyl-2,3,7,11-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7-tetraene
CID 90628428
5-methoxy-2-(2-methyl-6-phenylpyrazolo[1,5-a]pyrimidin-7-yl)phenol
CID 139216903
6,7-bis(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidine
CID 4204890
5-(3-methoxyphenyl)-1,3-dimethylpyrazole
CID 57246578
2-(3-methoxyphenyl)-5-methylpyrimidine
CID 121432653
[6-(3-methoxyphenyl)imidazo[1,2-b]pyridazin-3-yl]methanol
CID 116854486
2-(3-methoxyphenyl)-7,8-dihydro-6H-quinazolin-5-one
CID 62009055
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
3-(3-methoxyphenyl)-6-methyl-1H-pyrazin-2-one
CID 125458438
2-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 82371025
11-methyl-1,8,12-triazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraene
CID 66498173

Frequently Asked Questions

What is the IUPAC name of 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one?
The IUPAC name of 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one (CID 58034296) is 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one.
What is the SMILES notation for 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one?
The canonical SMILES for 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one is COc1cccc(C2=Cc3cnc4cc(C)nn4c3CC2=O)c1.
What is the InChIKey of 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one?
The InChIKey is NMQRWUFTGZEYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c1-11-6-18-19-10-13-8-15(12-4-3-5-14(7-12)23-2)17(22)9-16(13)21(18)20-11/h3-8,10H,9H2,1-2H3.
What are the key properties of 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one?
7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one has a molecular weight of 305.34 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-methoxyphenyl)-2-methyl-9H-pyrazolo[1,5-a]quinazolin-8-one is sourced from PubChem (CID 58034296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).