N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide

C18H22N6O2 — CID 167757142

IUPACN-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide
SMILESCCn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1ccc2[nH]cnc2n1
InChIInChI=1S/C18H22N6O2/c1-2-24-15(7-8-22-24)16-12(4-3-9-26-16)10-19-18(25)14-6-5-13-17(23-14)21-11-20-13/h5-8,11-12,16H,2-4,9-10H2,1H3,(H,19,25)(H,20,21,23)/t12-,16+/m0/s1
InChIKeyOSYRXJCRLJQFQT-BLLLJJGKSA-N
MW354.41 g/mol
LogP2.07
Rot. Bonds5

About N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide

N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide (PubChem CID 167757142) has the molecular formula C18H22N6O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide
PubChem CID167757142
Molecular FormulaC18H22N6O2
Molecular Weight354.41 g/mol
Exact Mass354.18
IUPAC NameN-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide
SMILESCCn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1ccc2[nH]cnc2n1
InChIInChI=1S/C18H22N6O2/c1-2-24-15(7-8-22-24)16-12(4-3-9-26-16)10-19-18(25)14-6-5-13-17(23-14)21-11-20-13/h5-8,11-12,16H,2-4,9-10H2,1H3,(H,19,25)(H,20,21,23)/t12-,16+/m0/s1
InChIKeyOSYRXJCRLJQFQT-BLLLJJGKSA-N
XLogP2.07
TPSA97.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide 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

N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-1,2,4-triazole-5-carboxamide
CID 167829016
1-(2,5-dimethylpyrazol-3-yl)-3-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]urea
CID 131961800
N-[4-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]methylamino]cyclohexyl]acetamide
CID 128976188
N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]isoquinolin-6-amine
CID 167830379
(3R)-N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]methyl]thian-3-amine
CID 129343353
N-[(2R,3R)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]-2-methyl-1H-imidazo[4,5-b]pyridine-7-carboxamide
CID 136584076
[(3aR,6aR)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-(1H-imidazo[4,5-b]pyridin-5-yl)methanone
CID 97254888
N-[[(2S)-oxolan-2-yl]methyl]-6-pyrazol-1-ylpyridazine-3-carboxamide
CID 95985471
5-[[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxan-3-yl]methylcarbamoyl]furan-2-carboxylic acid
CID 146135749
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethyl)-1-[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]methanamine
CID 129007044
6-[(2-tert-butyloxan-3-yl)methylcarbamoyl]pyridine-2-carboxylic acid
CID 119186019
1-[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxolan-3-yl]-N-(imidazo[1,2-a]pyridin-5-ylmethyl)methanamine
CID 128992159

Frequently Asked Questions

What is the IUPAC name of N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide?
The IUPAC name of N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide (CID 167757142) is N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide.
What is the SMILES notation for N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide?
The canonical SMILES for N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide is CCn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1ccc2[nH]cnc2n1.
What is the InChIKey of N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide?
The InChIKey is OSYRXJCRLJQFQT-BLLLJJGKSA-N. The full InChI is InChI=1S/C18H22N6O2/c1-2-24-15(7-8-22-24)16-12(4-3-9-26-16)10-19-18(25)14-6-5-13-17(23-14)21-11-20-13/h5-8,11-12,16H,2-4,9-10H2,1H3,(H,19,25)(H,20,21,23)/t12-,16+/m0/s1.
What are the key properties of N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide?
N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R,3S)-2-(2-ethylpyrazol-3-yl)oxan-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-5-carboxamide is sourced from PubChem (CID 167757142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).