5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline

C21H23N3O2 — CID 5182047

IUPAC5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
SMILESCOc1ccc(OC)c(C2Nc3c(C)cc(C)cc3-c3cc(C)nn32)c1
InChIInChI=1S/C21H23N3O2/c1-12-8-13(2)20-16(9-12)18-10-14(3)23-24(18)21(22-20)17-11-15(25-4)6-7-19(17)26-5/h6-11,21-22H,1-5H3
InChIKeyDIAZZOAUHKEUIQ-UHFFFAOYSA-N
MW349.43 g/mol
LogP4.46
Rot. Bonds3

About 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline

5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline (PubChem CID 5182047) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
PubChem CID5182047
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC Name5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
SMILESCOc1ccc(OC)c(C2Nc3c(C)cc(C)cc3-c3cc(C)nn32)c1
InChIInChI=1S/C21H23N3O2/c1-12-8-13(2)20-16(9-12)18-10-14(3)23-24(18)21(22-20)17-11-15(25-4)6-7-19(17)26-5/h6-11,21-22H,1-5H3
InChIKeyDIAZZOAUHKEUIQ-UHFFFAOYSA-N
XLogP4.46
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Ethoxy-6-{2-methyl-5H,6H-pyrazolo[1,5-C]quinazolin-5-YL}phenol
CID 3158660
5-Benzo[1,3]dioxol-5-yl-2,7-dimethyl-5,6-dihydro-pyrazolo[1,5-c]quinazoline
CID 644653
5-Benzo[1,3]dioxol-5-yl-2,7,9-trimethyl-5,6-dihydro-pyrazolo[1,5-c]quinazoline
CID 648825
5-Benzo[1,3]dioxol-5-yl-2,9-dimethyl-5,6-dihydro-pyrazolo[1,5-c]quinazoline
CID 652264
5-(3,4-Dimethoxyphenyl)-2-methyl-5H,6H-pyrazolo[1,5-C]quinazoline
CID 3158645
2-Methoxy-4-(9-methyl(5,6,7-trihydropyrazolo[1,5-c]quinazolin-6-yl))phenol
CID 3158653
5-(2,4-Dimethoxyphenyl)-2-methyl-5H,6H-pyrazolo[1,5-C]quinazoline
CID 3158644
5-(4-Ethoxyphenyl)-2,7-dimethyl-5H,6H-pyrazolo[1,5-C]quinazoline
CID 3158746
2,7-Dimethyl-5-(2,4,5-trimethoxyphenyl)-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 3158758
Pyrazolo[1,5-c]quinazoline, 5,6-dihydro-5-(4-methoxyphenyl)-2-methyl-
CID 3158652
3-(2-Methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)benzene-1,2-diol
CID 3158665
2,7,9-Trimethyl-5-(2,4,5-trimethoxyphenyl)-5H,6H-pyrazolo[1,5-C]quinazoline
CID 3158725

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The IUPAC name of 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline (CID 5182047) is 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline.
What is the SMILES notation for 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The canonical SMILES for 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline is COc1ccc(OC)c(C2Nc3c(C)cc(C)cc3-c3cc(C)nn32)c1.
What is the InChIKey of 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The InChIKey is DIAZZOAUHKEUIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-12-8-13(2)20-16(9-12)18-10-14(3)23-24(18)21(22-20)17-11-15(25-4)6-7-19(17)26-5/h6-11,21-22H,1-5H3.
What are the key properties of 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline has a molecular weight of 349.43 g/mol, XLogP of 4.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethoxyphenyl)-2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline is sourced from PubChem (CID 5182047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).