N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide

C17H18N6O2 — CID 128989290

IUPACN-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccc2nccn2c1
InChIInChI=1S/C17H18N6O2/c1-22-13(6-7-19-22)16-12(3-5-15(24)21-16)20-17(25)11-2-4-14-18-8-9-23(14)10-11/h2,4,6-10,12,16H,3,5H2,1H3,(H,20,25)(H,21,24)/t12-,16-/m1/s1
InChIKeyONZWYCNRCAWQBZ-MLGOLLRUSA-N
MW338.37 g/mol
LogP0.82
Rot. Bonds3

About N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide

N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 128989290) has the molecular formula C17H18N6O2 and a molecular weight of 338.37 g/mol. Its IUPAC name is N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID128989290
Molecular FormulaC17H18N6O2
Molecular Weight338.37 g/mol
Exact Mass338.15
IUPAC NameN-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccc2nccn2c1
InChIInChI=1S/C17H18N6O2/c1-22-13(6-7-19-22)16-12(3-5-15(24)21-16)20-17(25)11-2-4-14-18-8-9-23(14)10-11/h2,4,6-10,12,16H,3,5H2,1H3,(H,20,25)(H,21,24)/t12-,16-/m1/s1
InChIKeyONZWYCNRCAWQBZ-MLGOLLRUSA-N
XLogP0.82
TPSA93.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide (CID 128989290) is N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide is Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccc2nccn2c1.
What is the InChIKey of N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is ONZWYCNRCAWQBZ-MLGOLLRUSA-N. The full InChI is InChI=1S/C17H18N6O2/c1-22-13(6-7-19-22)16-12(3-5-15(24)21-16)20-17(25)11-2-4-14-18-8-9-23(14)10-11/h2,4,6-10,12,16H,3,5H2,1H3,(H,20,25)(H,21,24)/t12-,16-/m1/s1.
What are the key properties of N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 338.37 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 128989290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).