methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate

C19H22N4O4 — CID 171656116

IUPACmethyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCOC(=O)c1cnn2ccc(-c3cnn(CC4(O)CCOCC4)c3C)cc12
InChIInChI=1S/C19H22N4O4/c1-13-15(10-21-23(13)12-19(25)4-7-27-8-5-19)14-3-6-22-17(9-14)16(11-20-22)18(24)26-2/h3,6,9-11,25H,4-5,7-8,12H2,1-2H3
InChIKeyHGBLFESQIBOFJI-UHFFFAOYSA-N
MW370.41 g/mol
LogP1.83
Rot. Bonds4

About methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate

methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate (PubChem CID 171656116) has the molecular formula C19H22N4O4 and a molecular weight of 370.41 g/mol. Its IUPAC name is methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate
PubChem CID171656116
Molecular FormulaC19H22N4O4
Molecular Weight370.41 g/mol
Exact Mass370.16
IUPAC Namemethyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate
SMILESCOC(=O)c1cnn2ccc(-c3cnn(CC4(O)CCOCC4)c3C)cc12
InChIInChI=1S/C19H22N4O4/c1-13-15(10-21-23(13)12-19(25)4-7-27-8-5-19)14-3-6-22-17(9-14)16(11-20-22)18(24)26-2/h3,6,9-11,25H,4-5,7-8,12H2,1-2H3
InChIKeyHGBLFESQIBOFJI-UHFFFAOYSA-N
XLogP1.83
TPSA90.88 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate with MolForge

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Related Compounds

methyl 5-methylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 53399588
methyl 5-[1-(2-hydroxy-2-methylpropyl)-3-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 171656041
methyl 5-iodopyrazolo[1,5-a]pyridine-3-carboxylate
CID 121231756
methyl 5-[1-[(2S)-2-hydroxy-3-methoxypropyl]pyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 171656393
ethyl 5-[(4-phenyloxane-4-carbonyl)amino]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71797817
methyl 5-(2-bromoethoxy)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 134548276
methyl 5-[3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]-2-methylfuran-3-carboxylate
CID 154690969
ethyl 5-(2-amino-4,6-dimethylpyrimidin-5-yl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 176643568
methyl 5-[[2-(oxolan-2-ylmethoxy)acetyl]amino]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 126831946
ethyl 5-(hydroxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylate
CID 71464261
N-[2-chloro-5-[5-[(1S,2R)-2-fluorocyclopropyl]tetrazol-2-yl]phenyl]-5-[1-[(4-hydroxyoxan-4-yl)methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 171655930
5-[2-[(4-ethyl-4-hydroxycyclohexyl)amino]-4-methoxypyrrolo[2,1-f][1,2,4]triazin-5-yl]-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 170657316

Frequently Asked Questions

What is the IUPAC name of methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate?
The IUPAC name of methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate (CID 171656116) is methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate.
What is the SMILES notation for methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate?
The canonical SMILES for methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate is COC(=O)c1cnn2ccc(-c3cnn(CC4(O)CCOCC4)c3C)cc12.
What is the InChIKey of methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate?
The InChIKey is HGBLFESQIBOFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O4/c1-13-15(10-21-23(13)12-19(25)4-7-27-8-5-19)14-3-6-22-17(9-14)16(11-20-22)18(24)26-2/h3,6,9-11,25H,4-5,7-8,12H2,1-2H3.
What are the key properties of methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate?
methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate has a molecular weight of 370.41 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-[1-[(4-hydroxyoxan-4-yl)methyl]-5-methylpyrazol-4-yl]pyrazolo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 171656116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).