6-ethyl-1H-pyrazolo[5,4-b]quinoline

C12H11N3 — CID 865231

IUPAC6-ethyl-1H-pyrazolo[5,4-b]quinoline
SMILESCCc1ccc2nc3[nH]ncc3cc2c1
InChIInChI=1S/C12H11N3/c1-2-8-3-4-11-9(5-8)6-10-7-13-15-12(10)14-11/h3-7H,2H2,1H3,(H,13,14,15)
InChIKeyMZEVLWHPUGKOHO-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.67
Rot. Bonds1

About 6-ethyl-1H-pyrazolo[5,4-b]quinoline

6-ethyl-1H-pyrazolo[5,4-b]quinoline (PubChem CID 865231) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 6-ethyl-1H-pyrazolo[5,4-b]quinoline.

Molecular Properties

Compound Name6-ethyl-1H-pyrazolo[5,4-b]quinoline
PubChem CID865231
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name6-ethyl-1H-pyrazolo[5,4-b]quinoline
SMILESCCc1ccc2nc3[nH]ncc3cc2c1
InChIInChI=1S/C12H11N3/c1-2-8-3-4-11-9(5-8)6-10-7-13-15-12(10)14-11/h3-7H,2H2,1H3,(H,13,14,15)
InChIKeyMZEVLWHPUGKOHO-UHFFFAOYSA-N
XLogP2.67
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1H-pyrazolo[5,4-b]quinoline?
The IUPAC name of 6-ethyl-1H-pyrazolo[5,4-b]quinoline (CID 865231) is 6-ethyl-1H-pyrazolo[5,4-b]quinoline.
What is the SMILES notation for 6-ethyl-1H-pyrazolo[5,4-b]quinoline?
The canonical SMILES for 6-ethyl-1H-pyrazolo[5,4-b]quinoline is CCc1ccc2nc3[nH]ncc3cc2c1.
What is the InChIKey of 6-ethyl-1H-pyrazolo[5,4-b]quinoline?
The InChIKey is MZEVLWHPUGKOHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c1-2-8-3-4-11-9(5-8)6-10-7-13-15-12(10)14-11/h3-7H,2H2,1H3,(H,13,14,15).
What are the key properties of 6-ethyl-1H-pyrazolo[5,4-b]quinoline?
6-ethyl-1H-pyrazolo[5,4-b]quinoline has a molecular weight of 197.24 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1H-pyrazolo[5,4-b]quinoline is sourced from PubChem (CID 865231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).