4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine

C19H18N6O2 — CID 66829130

IUPAC4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine
SMILESc1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)cc(-c2cn[nH]c2)n1
InChIInChI=1S/C19H18N6O2/c1-5-20-16(13-10-22-23-11-13)9-12(1)18-17-15(24-25-18)2-6-21-19(17)27-14-3-7-26-8-4-14/h1-2,5-6,9-11,14H,3-4,7-8H2,(H,22,23)(H,24,25)
InChIKeyNGKZEHUBRCMYIH-UHFFFAOYSA-N
MW362.39 g/mol
LogP2.97
Rot. Bonds4

About 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine

4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine (PubChem CID 66829130) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine
PubChem CID66829130
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC Name4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine
SMILESc1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)cc(-c2cn[nH]c2)n1
InChIInChI=1S/C19H18N6O2/c1-5-20-16(13-10-22-23-11-13)9-12(1)18-17-15(24-25-18)2-6-21-19(17)27-14-3-7-26-8-4-14/h1-2,5-6,9-11,14H,3-4,7-8H2,(H,22,23)(H,24,25)
InChIKeyNGKZEHUBRCMYIH-UHFFFAOYSA-N
XLogP2.97
TPSA101.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine (CID 66829130) is 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine is c1cc(-c2n[nH]c3ccnc(OC4CCOCC4)c23)cc(-c2cn[nH]c2)n1.
What is the InChIKey of 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is NGKZEHUBRCMYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c1-5-20-16(13-10-22-23-11-13)9-12(1)18-17-15(24-25-18)2-6-21-19(17)27-14-3-7-26-8-4-14/h1-2,5-6,9-11,14H,3-4,7-8H2,(H,22,23)(H,24,25).
What are the key properties of 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine?
4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 362.39 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxan-4-yloxy)-3-[2-(1H-pyrazol-4-yl)-4-pyridinyl]-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 66829130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).