(7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine

C15H21N3OS — CID 97382482

About (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine

(7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine (PubChem CID 97382482) has the molecular formula C15H21N3OS and a molecular weight of 291.42 g/mol. Its IUPAC name is (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine.

Molecular Properties

• Compound Name: (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
• PubChem CID: 97382482
• Molecular Formula: C15H21N3OS
• Molecular Weight: 291.42 g/mol
• Exact Mass: 291.14
• IUPAC Name: (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
• SMILES: CCOC[C@@H]1CN(Cc2ccsc2)Cc2cn(C)nc21
• InChI: InChI=1S/C15H21N3OS/c1-3-19-10-14-9-18(6-12-4-5-20-11-12)8-13-7-17(2)16-15(13)14/h4-5,7,11,14H,3,6,8-10H2,1-2H3/t14-/m0/s1
• InChIKey: CXTLGJVQRPCCGT-AWEZNQCLSA-N
• XLogP: 2.62
• TPSA: 30.29 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	291.42
LogP ≤ 5	2.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?

The IUPAC name of (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine (CID 97382482) is (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine.

What is the SMILES notation for (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?

The canonical SMILES for (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine is CCOC[C@@H]1CN(Cc2ccsc2)Cc2cn(C)nc21.

What is the InChIKey of (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?

The InChIKey is CXTLGJVQRPCCGT-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-3-19-10-14-9-18(6-12-4-5-20-11-12)8-13-7-17(2)16-15(13)14/h4-5,7,11,14H,3,6,8-10H2,1-2H3/t14-/m0/s1.

What are the key properties of (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?

(7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine has a molecular weight of 291.42 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (7R)-7-(ethoxymethyl)-2-methyl-5-(thiophen-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 97382482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).