4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine

C16H19N5O2 — CID 66829134

IUPAC4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine
SMILESCC(C)n1cc(-c2n[nH]c3ccnc(OC4CCOC4)c23)cn1
InChIInChI=1S/C16H19N5O2/c1-10(2)21-8-11(7-18-21)15-14-13(19-20-15)3-5-17-16(14)23-12-4-6-22-9-12/h3,5,7-8,10,12H,4,6,9H2,1-2H3,(H,19,20)
InChIKeyUEBUDJGQCMCAIR-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.57
Rot. Bonds4

About 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine

4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine (PubChem CID 66829134) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine
PubChem CID66829134
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC Name4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine
SMILESCC(C)n1cc(-c2n[nH]c3ccnc(OC4CCOC4)c23)cn1
InChIInChI=1S/C16H19N5O2/c1-10(2)21-8-11(7-18-21)15-14-13(19-20-15)3-5-17-16(14)23-12-4-6-22-9-12/h3,5,7-8,10,12H,4,6,9H2,1-2H3,(H,19,20)
InChIKeyUEBUDJGQCMCAIR-UHFFFAOYSA-N
XLogP2.57
TPSA77.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine (CID 66829134) is 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine is CC(C)n1cc(-c2n[nH]c3ccnc(OC4CCOC4)c23)cn1.
What is the InChIKey of 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is UEBUDJGQCMCAIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c1-10(2)21-8-11(7-18-21)15-14-13(19-20-15)3-5-17-16(14)23-12-4-6-22-9-12/h3,5,7-8,10,12H,4,6,9H2,1-2H3,(H,19,20).
What are the key properties of 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine?
4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 313.36 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-3-yloxy)-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 66829134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).