2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide

C23H24N4O2 — CID 1395744

IUPAC2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide
SMILESCCCn1nc(NC(=O)c2ccccc2OCC)c2cc3cc(C)ccc3nc21
InChIInChI=1S/C23H24N4O2/c1-4-12-27-22-18(14-16-13-15(3)10-11-19(16)24-22)21(26-27)25-23(28)17-8-6-7-9-20(17)29-5-2/h6-11,13-14H,4-5,12H2,1-3H3,(H,25,26,28)
InChIKeyVOPUGBRGEJAWAV-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.95
Rot. Bonds6

About 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide

2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide (PubChem CID 1395744) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide
PubChem CID1395744
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide
SMILESCCCn1nc(NC(=O)c2ccccc2OCC)c2cc3cc(C)ccc3nc21
InChIInChI=1S/C23H24N4O2/c1-4-12-27-22-18(14-16-13-15(3)10-11-19(16)24-22)21(26-27)25-23(28)17-8-6-7-9-20(17)29-5-2/h6-11,13-14H,4-5,12H2,1-3H3,(H,25,26,28)
InChIKeyVOPUGBRGEJAWAV-UHFFFAOYSA-N
XLogP4.95
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide?
The IUPAC name of 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide (CID 1395744) is 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide?
The canonical SMILES for 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide is CCCn1nc(NC(=O)c2ccccc2OCC)c2cc3cc(C)ccc3nc21.
What is the InChIKey of 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide?
The InChIKey is VOPUGBRGEJAWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-4-12-27-22-18(14-16-13-15(3)10-11-19(16)24-22)21(26-27)25-23(28)17-8-6-7-9-20(17)29-5-2/h6-11,13-14H,4-5,12H2,1-3H3,(H,25,26,28).
What are the key properties of 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide?
2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide has a molecular weight of 388.47 g/mol, XLogP of 4.95, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(6-methyl-1-propylpyrazolo[5,4-b]quinolin-3-yl)benzamide is sourced from PubChem (CID 1395744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).