ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate

C18H24N2O6 — CID 58013967

IUPACethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(COC2CCCCO2)nn2c(OC)ccc(CO)c12
InChIInChI=1S/C18H24N2O6/c1-3-24-18(22)16-13(11-26-15-6-4-5-9-25-15)19-20-14(23-2)8-7-12(10-21)17(16)20/h7-8,15,21H,3-6,9-11H2,1-2H3
InChIKeyCHACTSZGMPEDPB-UHFFFAOYSA-N
MW364.40 g/mol
LogP2.06
Rot. Bonds7

About ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate

ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate (PubChem CID 58013967) has the molecular formula C18H24N2O6 and a molecular weight of 364.40 g/mol. Its IUPAC name is ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
PubChem CID58013967
Molecular FormulaC18H24N2O6
Molecular Weight364.40 g/mol
Exact Mass364.16
IUPAC Nameethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(COC2CCCCO2)nn2c(OC)ccc(CO)c12
InChIInChI=1S/C18H24N2O6/c1-3-24-18(22)16-13(11-26-15-6-4-5-9-25-15)19-20-14(23-2)8-7-12(10-21)17(16)20/h7-8,15,21H,3-6,9-11H2,1-2H3
InChIKeyCHACTSZGMPEDPB-UHFFFAOYSA-N
XLogP2.06
TPSA91.52 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate with MolForge

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

Launch Full Analysis

Related Compounds

ethyl 4-(hydroxymethyl)-7-methoxy-2-(1,1,2,2,2-pentafluoroethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 59389380
methyl 3-[(4-methoxyphenyl)methyl]-5-(oxan-2-yloxymethyl)triazole-4-carboxylate
CID 67023050
ethyl 1-[2-(oxan-2-yloxy)ethyl]-3-propan-2-ylpyrazole-5-carboxylate
CID 59984579
ethyl 2-[3-(oxan-2-yloxy)propyl]pyrazole-3-carboxylate
CID 166889045
ethyl 6-(oxan-2-yloxymethyl)-4-phenylmethoxypyridine-2-carboxylate
CID 66599851
ethyl 3-iodo-4-(oxan-2-yloxymethyl)-1H-indole-2-carboxylate
CID 134839225
ethyl 1-(2-methoxy-2-oxoethyl)-3-(oxan-2-yloxymethyl)-1H-indene-2-carboxylate
CID 11153026
[4-(oxan-2-yloxymethyl)phenyl]methyl carbamate
CID 151097937
methyl 2,6-diethyl-4-(4-fluorophenyl)-5-(oxan-2-yloxymethyl)pyridine-3-carboxylate
CID 14652778
tert-butyl 3-[[(2R)-oxan-2-yl]oxymethyl]pyrazolo[3,4-b]pyridine-1-carboxylate
CID 94840528
ethyl 2-ethyl-4-(hydroxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 58014043
1-[5-[[(2S)-oxan-2-yl]oxymethyl]-1,2-oxazol-3-yl]ethanone
CID 86339553

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate (CID 58013967) is ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate is CCOC(=O)c1c(COC2CCCCO2)nn2c(OC)ccc(CO)c12.
What is the InChIKey of ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
The InChIKey is CHACTSZGMPEDPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O6/c1-3-24-18(22)16-13(11-26-15-6-4-5-9-25-15)19-20-14(23-2)8-7-12(10-21)17(16)20/h7-8,15,21H,3-6,9-11H2,1-2H3.
What are the key properties of ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate?
ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate has a molecular weight of 364.40 g/mol, XLogP of 2.06, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(hydroxymethyl)-7-methoxy-2-(oxan-2-yloxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 58013967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).