3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline

C18H16N4 — CID 67502103

IUPAC3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline
SMILESCC(C)c1[nH]nc2ccnc(-c3cnc4ccccc4c3)c12
InChIInChI=1S/C18H16N4/c1-11(2)17-16-15(21-22-17)7-8-19-18(16)13-9-12-5-3-4-6-14(12)20-10-13/h3-11H,1-2H3,(H,21,22)
InChIKeyHKAVJXNXVNEEMH-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.30
Rot. Bonds2

About 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline

3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline (PubChem CID 67502103) has the molecular formula C18H16N4 and a molecular weight of 288.35 g/mol. Its IUPAC name is 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline.

Molecular Properties

Compound Name3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline
PubChem CID67502103
Molecular FormulaC18H16N4
Molecular Weight288.35 g/mol
Exact Mass288.14
IUPAC Name3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline
SMILESCC(C)c1[nH]nc2ccnc(-c3cnc4ccccc4c3)c12
InChIInChI=1S/C18H16N4/c1-11(2)17-16-15(21-22-17)7-8-19-18(16)13-9-12-5-3-4-6-14(12)20-10-13/h3-11H,1-2H3,(H,21,22)
InChIKeyHKAVJXNXVNEEMH-UHFFFAOYSA-N
XLogP4.30
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline?
The IUPAC name of 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline (CID 67502103) is 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline.
What is the SMILES notation for 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline?
The canonical SMILES for 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline is CC(C)c1[nH]nc2ccnc(-c3cnc4ccccc4c3)c12.
What is the InChIKey of 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline?
The InChIKey is HKAVJXNXVNEEMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4/c1-11(2)17-16-15(21-22-17)7-8-19-18(16)13-9-12-5-3-4-6-14(12)20-10-13/h3-11H,1-2H3,(H,21,22).
What are the key properties of 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline?
3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline has a molecular weight of 288.35 g/mol, XLogP of 4.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-propan-2-yl-2H-pyrazolo[4,3-c]pyridin-4-yl)quinoline is sourced from PubChem (CID 67502103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).