N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide

C19H21N3O3 — CID 125445269

IUPACN-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
SMILESCCOC[C@@H](O)CNC(=O)c1ccc(-c2cnn3ccccc23)cc1
InChIInChI=1S/C19H21N3O3/c1-2-25-13-16(23)11-20-19(24)15-8-6-14(7-9-15)17-12-21-22-10-4-3-5-18(17)22/h3-10,12,16,23H,2,11,13H2,1H3,(H,20,24)/t16-/m0/s1
InChIKeyISPYBFHDDLYMOB-INIZCTEOSA-N
MW339.40 g/mol
LogP2.13
Rot. Bonds7

About N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide

N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide (PubChem CID 125445269) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide.

Molecular Properties

Compound NameN-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
PubChem CID125445269
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC NameN-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
SMILESCCOC[C@@H](O)CNC(=O)c1ccc(-c2cnn3ccccc23)cc1
InChIInChI=1S/C19H21N3O3/c1-2-25-13-16(23)11-20-19(24)15-8-6-14(7-9-15)17-12-21-22-10-4-3-5-18(17)22/h3-10,12,16,23H,2,11,13H2,1H3,(H,20,24)/t16-/m0/s1
InChIKeyISPYBFHDDLYMOB-INIZCTEOSA-N
XLogP2.13
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
CID 171682360
N-[2-[(2S)-2-(hydroxymethyl)piperidin-1-yl]ethyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
CID 125446361
3-(5-chloro-2-fluorophenyl)-N-[(2R)-3-ethoxy-2-hydroxypropyl]benzamide
CID 126440716
2-ethoxy-N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103127669
3-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2S)-3-ethoxy-2-hydroxypropyl]benzamide
CID 125171716
N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide
CID 172887533
N-(2-bromo-3-methoxypropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122688
(2S)-2-hydroxy-3-(pyrazolo[1,5-a]pyridine-3-carbonylamino)propanoic acid
CID 107833160
morpholin-4-yl-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)methanone
CID 144901391
N-[2-hydroxy-3-(2-methylpropoxy)propyl]-3-pyrazol-1-ylbenzamide
CID 111697672
4-chloro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)benzamide
CID 90538445
N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxybenzamide
CID 51903313

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
The IUPAC name of N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide (CID 125445269) is N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide.
What is the SMILES notation for N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
The canonical SMILES for N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide is CCOC[C@@H](O)CNC(=O)c1ccc(-c2cnn3ccccc23)cc1.
What is the InChIKey of N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
The InChIKey is ISPYBFHDDLYMOB-INIZCTEOSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-2-25-13-16(23)11-20-19(24)15-8-6-14(7-9-15)17-12-21-22-10-4-3-5-18(17)22/h3-10,12,16,23H,2,11,13H2,1H3,(H,20,24)/t16-/m0/s1.
What are the key properties of N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide?
N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide has a molecular weight of 339.40 g/mol, XLogP of 2.13, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-3-ethoxy-2-hydroxypropyl]-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide is sourced from PubChem (CID 125445269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).