2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline

C17H12N4 — CID 71255097

IUPAC2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline
SMILESC(=Cc1ccc2ccc3[nH]ncc3c2n1)c1ccccn1
InChIInChI=1S/C17H12N4/c1-2-10-18-13(3-1)7-8-14-6-4-12-5-9-16-15(11-19-21-16)17(12)20-14/h1-11H,(H,19,21)
InChIKeyBZXOEEITXREACD-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.68
Rot. Bonds2

About 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline

2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline (PubChem CID 71255097) has the molecular formula C17H12N4 and a molecular weight of 272.31 g/mol. Its IUPAC name is 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline.

Molecular Properties

Compound Name2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline
PubChem CID71255097
Molecular FormulaC17H12N4
Molecular Weight272.31 g/mol
Exact Mass272.11
IUPAC Name2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline
SMILESC(=Cc1ccc2ccc3[nH]ncc3c2n1)c1ccccn1
InChIInChI=1S/C17H12N4/c1-2-10-18-13(3-1)7-8-14-6-4-12-5-9-16-15(11-19-21-16)17(12)20-14/h1-11H,(H,19,21)
InChIKeyBZXOEEITXREACD-UHFFFAOYSA-N
XLogP3.68
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline?
The IUPAC name of 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline (CID 71255097) is 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline.
What is the SMILES notation for 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline?
The canonical SMILES for 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline is C(=Cc1ccc2ccc3[nH]ncc3c2n1)c1ccccn1.
What is the InChIKey of 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline?
The InChIKey is BZXOEEITXREACD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4/c1-2-10-18-13(3-1)7-8-14-6-4-12-5-9-16-15(11-19-21-16)17(12)20-14/h1-11H,(H,19,21).
What are the key properties of 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline?
2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline has a molecular weight of 272.31 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-2-ylethenyl)-7H-pyrazolo[5,4-h]quinoline is sourced from PubChem (CID 71255097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).