N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide

C20H20N4O2 — CID 95315176

IUPACN-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCCN(C(=O)c1ccc2nccn2c1)[C@@H]1CCN(c2ccccc2)C1=O
InChIInChI=1S/C20H20N4O2/c1-2-23(19(25)15-8-9-18-21-11-13-22(18)14-15)17-10-12-24(20(17)26)16-6-4-3-5-7-16/h3-9,11,13-14,17H,2,10,12H2,1H3/t17-/m1/s1
InChIKeyLXXORQFGQGDLNI-QGZVFWFLSA-N
MW348.41 g/mol
LogP2.60
Rot. Bonds4

About N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide

N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 95315176) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID95315176
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCCN(C(=O)c1ccc2nccn2c1)[C@@H]1CCN(c2ccccc2)C1=O
InChIInChI=1S/C20H20N4O2/c1-2-23(19(25)15-8-9-18-21-11-13-22(18)14-15)17-10-12-24(20(17)26)16-6-4-3-5-7-16/h3-9,11,13-14,17H,2,10,12H2,1H3/t17-/m1/s1
InChIKeyLXXORQFGQGDLNI-QGZVFWFLSA-N
XLogP2.60
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide (CID 95315176) is N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide is CCN(C(=O)c1ccc2nccn2c1)[C@@H]1CCN(c2ccccc2)C1=O.
What is the InChIKey of N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is LXXORQFGQGDLNI-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-2-23(19(25)15-8-9-18-21-11-13-22(18)14-15)17-10-12-24(20(17)26)16-6-4-3-5-7-16/h3-9,11,13-14,17H,2,10,12H2,1H3/t17-/m1/s1.
What are the key properties of N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide?
N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 95315176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).