5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one

C18H16N4O — CID 71537552

IUPAC5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one
SMILESCCCn1c(=O)c2cn[nH]c2c2ccc(-c3ccncc3)cc21
InChIInChI=1S/C18H16N4O/c1-2-9-22-16-10-13(12-5-7-19-8-6-12)3-4-14(16)17-15(18(22)23)11-20-21-17/h3-8,10-11H,2,9H2,1H3,(H,20,21)
InChIKeyBPLNZOQGPAGRTJ-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.35
Rot. Bonds3

About 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one

5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one (PubChem CID 71537552) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one.

Molecular Properties

Compound Name5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one
PubChem CID71537552
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC Name5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one
SMILESCCCn1c(=O)c2cn[nH]c2c2ccc(-c3ccncc3)cc21
InChIInChI=1S/C18H16N4O/c1-2-9-22-16-10-13(12-5-7-19-8-6-12)3-4-14(16)17-15(18(22)23)11-20-21-17/h3-8,10-11H,2,9H2,1H3,(H,20,21)
InChIKeyBPLNZOQGPAGRTJ-UHFFFAOYSA-N
XLogP3.35
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one?
The IUPAC name of 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one (CID 71537552) is 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one.
What is the SMILES notation for 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one?
The canonical SMILES for 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one is CCCn1c(=O)c2cn[nH]c2c2ccc(-c3ccncc3)cc21.
What is the InChIKey of 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one?
The InChIKey is BPLNZOQGPAGRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-2-9-22-16-10-13(12-5-7-19-8-6-12)3-4-14(16)17-15(18(22)23)11-20-21-17/h3-8,10-11H,2,9H2,1H3,(H,20,21).
What are the key properties of 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one?
5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one has a molecular weight of 304.35 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-7-pyridin-4-yl-1H-pyrazolo[4,5-c]quinolin-4-one is sourced from PubChem (CID 71537552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).