8-(1H-indazol-5-yl)quinoline

C16H11N3 — CID 50950543

IUPAC8-(1H-indazol-5-yl)quinoline
SMILESc1cnc2c(-c3ccc4[nH]ncc4c3)cccc2c1
InChIInChI=1S/C16H11N3/c1-3-11-4-2-8-17-16(11)14(5-1)12-6-7-15-13(9-12)10-18-19-15/h1-10H,(H,18,19)
InChIKeyUUEHIZXDQXPICX-UHFFFAOYSA-N
MW245.29 g/mol
LogP3.78
Rot. Bonds1

About 8-(1H-indazol-5-yl)quinoline

8-(1H-indazol-5-yl)quinoline (PubChem CID 50950543) has the molecular formula C16H11N3 and a molecular weight of 245.29 g/mol. Its IUPAC name is 8-(1H-indazol-5-yl)quinoline.

Molecular Properties

Compound Name8-(1H-indazol-5-yl)quinoline
PubChem CID50950543
Molecular FormulaC16H11N3
Molecular Weight245.29 g/mol
Exact Mass245.10
IUPAC Name8-(1H-indazol-5-yl)quinoline
SMILESc1cnc2c(-c3ccc4[nH]ncc4c3)cccc2c1
InChIInChI=1S/C16H11N3/c1-3-11-4-2-8-17-16(11)14(5-1)12-6-7-15-13(9-12)10-18-19-15/h1-10H,(H,18,19)
InChIKeyUUEHIZXDQXPICX-UHFFFAOYSA-N
XLogP3.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(1H-indazol-5-yl)quinoline?
The IUPAC name of 8-(1H-indazol-5-yl)quinoline (CID 50950543) is 8-(1H-indazol-5-yl)quinoline.
What is the SMILES notation for 8-(1H-indazol-5-yl)quinoline?
The canonical SMILES for 8-(1H-indazol-5-yl)quinoline is c1cnc2c(-c3ccc4[nH]ncc4c3)cccc2c1.
What is the InChIKey of 8-(1H-indazol-5-yl)quinoline?
The InChIKey is UUEHIZXDQXPICX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3/c1-3-11-4-2-8-17-16(11)14(5-1)12-6-7-15-13(9-12)10-18-19-15/h1-10H,(H,18,19).
What are the key properties of 8-(1H-indazol-5-yl)quinoline?
8-(1H-indazol-5-yl)quinoline has a molecular weight of 245.29 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1H-indazol-5-yl)quinoline is sourced from PubChem (CID 50950543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).