3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine

C18H19N3O3 — CID 155545855

IUPAC3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine
SMILESCOc1cc(-c2nccc3n[nH]c(C4CC4)c23)cc(OC)c1OC
InChIInChI=1S/C18H19N3O3/c1-22-13-8-11(9-14(23-2)18(13)24-3)16-15-12(6-7-19-16)20-21-17(15)10-4-5-10/h6-10H,4-5H2,1-3H3,(H,20,21)
InChIKeyOHLODVBSBNEUIW-UHFFFAOYSA-N
MW325.37 g/mol
LogP3.53
Rot. Bonds5

About 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine

3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine (PubChem CID 155545855) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine
PubChem CID155545855
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine
SMILESCOc1cc(-c2nccc3n[nH]c(C4CC4)c23)cc(OC)c1OC
InChIInChI=1S/C18H19N3O3/c1-22-13-8-11(9-14(23-2)18(13)24-3)16-15-12(6-7-19-16)20-21-17(15)10-4-5-10/h6-10H,4-5H2,1-3H3,(H,20,21)
InChIKeyOHLODVBSBNEUIW-UHFFFAOYSA-N
XLogP3.53
TPSA69.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine (CID 155545855) is 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine is COc1cc(-c2nccc3n[nH]c(C4CC4)c23)cc(OC)c1OC.
What is the InChIKey of 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine?
The InChIKey is OHLODVBSBNEUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-22-13-8-11(9-14(23-2)18(13)24-3)16-15-12(6-7-19-16)20-21-17(15)10-4-5-10/h6-10H,4-5H2,1-3H3,(H,20,21).
What are the key properties of 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine?
3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine has a molecular weight of 325.37 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 155545855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).