4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine

C14H13N3O3S — CID 66825522

IUPAC4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine
SMILESCOc1nccc2[nH]nc(-c3cccc(S(C)(=O)=O)c3)c12
InChIInChI=1S/C14H13N3O3S/c1-20-14-12-11(6-7-15-14)16-17-13(12)9-4-3-5-10(8-9)21(2,18)19/h3-8H,1-2H3,(H,16,17)
InChIKeyGZNCTDNMFYHGSZ-UHFFFAOYSA-N
MW303.34 g/mol
LogP2.04
Rot. Bonds3

About 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine

4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine (PubChem CID 66825522) has the molecular formula C14H13N3O3S and a molecular weight of 303.34 g/mol. Its IUPAC name is 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine
PubChem CID66825522
Molecular FormulaC14H13N3O3S
Molecular Weight303.34 g/mol
Exact Mass303.07
IUPAC Name4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine
SMILESCOc1nccc2[nH]nc(-c3cccc(S(C)(=O)=O)c3)c12
InChIInChI=1S/C14H13N3O3S/c1-20-14-12-11(6-7-15-14)16-17-13(12)9-4-3-5-10(8-9)21(2,18)19/h3-8H,1-2H3,(H,16,17)
InChIKeyGZNCTDNMFYHGSZ-UHFFFAOYSA-N
XLogP2.04
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(3-methylsulfonylphenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
CID 130360897
3-[4-[3-(2-methoxy-4-pyridinyl)-5-methyl-1H-pyrazol-4-yl]phenyl]benzenesulfonamide
CID 166490633
3-[4-[5-(2-methoxy-4-pyridinyl)-1H-pyrazol-4-yl]phenyl]benzenesulfonamide
CID 166490667
N-[5-(1H-indazol-6-yl)-2-methoxy-3-pyridinyl]methanesulfonamide
CID 155533335
N-[2-[[[3-(6-methoxy-3-pyridinyl)-1H-indazol-5-yl]amino]methyl]phenyl]methanesulfonamide
CID 155556422
4-Methoxy-3-(2-(1-methyl-1H-pyrazol-4-yl)pyridin-4-yl)-1H-pyrazolo[4,3-c]pyridine
CID 56942986
4-methoxy-3-(2-methoxy-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridine
CID 66825430
3-(3-methylsulfonylphenyl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine
CID 66828981
4-methoxy-3-[2-(trifluoromethyl)pyridin-4-yl]-1H-pyrazolo[4,3-c]pyridine
CID 66829080
4-methoxy-3-(4-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine
CID 68069650
US9718825, Example 672
CID 136213563
US12565497, Example 33
CID 162523924

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine (CID 66825522) is 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine is COc1nccc2[nH]nc(-c3cccc(S(C)(=O)=O)c3)c12.
What is the InChIKey of 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is GZNCTDNMFYHGSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3S/c1-20-14-12-11(6-7-15-14)16-17-13(12)9-4-3-5-10(8-9)21(2,18)19/h3-8H,1-2H3,(H,16,17).
What are the key properties of 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine?
4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 303.34 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-(3-methylsulfonylphenyl)-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 66825522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).