4-methoxy-2-phenylpyrazolo[4,3-c]quinoline

C17H13N3O — CID 11196622

IUPAC4-methoxy-2-phenylpyrazolo[4,3-c]quinoline
SMILESCOc1nc2ccccc2c2nn(-c3ccccc3)cc12
InChIInChI=1S/C17H13N3O/c1-21-17-14-11-20(12-7-3-2-4-8-12)19-16(14)13-9-5-6-10-15(13)18-17/h2-11H,1H3
InChIKeyLBRDTSFKAURCRO-UHFFFAOYSA-N
MW275.31 g/mol
LogP3.58
Rot. Bonds2

About 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline

4-methoxy-2-phenylpyrazolo[4,3-c]quinoline (PubChem CID 11196622) has the molecular formula C17H13N3O and a molecular weight of 275.31 g/mol. Its IUPAC name is 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline.

Molecular Properties

Compound Name4-methoxy-2-phenylpyrazolo[4,3-c]quinoline
PubChem CID11196622
Molecular FormulaC17H13N3O
Molecular Weight275.31 g/mol
Exact Mass275.11
IUPAC Name4-methoxy-2-phenylpyrazolo[4,3-c]quinoline
SMILESCOc1nc2ccccc2c2nn(-c3ccccc3)cc12
InChIInChI=1S/C17H13N3O/c1-21-17-14-11-20(12-7-3-2-4-8-12)19-16(14)13-9-5-6-10-15(13)18-17/h2-11H,1H3
InChIKeyLBRDTSFKAURCRO-UHFFFAOYSA-N
XLogP3.58
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline?
The IUPAC name of 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline (CID 11196622) is 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline.
What is the SMILES notation for 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline?
The canonical SMILES for 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline is COc1nc2ccccc2c2nn(-c3ccccc3)cc12.
What is the InChIKey of 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline?
The InChIKey is LBRDTSFKAURCRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O/c1-21-17-14-11-20(12-7-3-2-4-8-12)19-16(14)13-9-5-6-10-15(13)18-17/h2-11H,1H3.
What are the key properties of 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline?
4-methoxy-2-phenylpyrazolo[4,3-c]quinoline has a molecular weight of 275.31 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-phenylpyrazolo[4,3-c]quinoline is sourced from PubChem (CID 11196622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).