1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide

C26H24N4O3 — CID 55388331

IUPAC1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide
SMILESCOc1ccc(C)cc1N1CC(C(=O)Nc2c(-c3ccccc3)nc3ccccn23)CC1=O
InChIInChI=1S/C26H24N4O3/c1-17-11-12-21(33-2)20(14-17)30-16-19(15-23(30)31)26(32)28-25-24(18-8-4-3-5-9-18)27-22-10-6-7-13-29(22)25/h3-14,19H,15-16H2,1-2H3,(H,28,32)
InChIKeyRYAFCZDZTWFLOL-UHFFFAOYSA-N
MW440.50 g/mol
LogP4.31
Rot. Bonds5

About 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide

1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide (PubChem CID 55388331) has the molecular formula C26H24N4O3 and a molecular weight of 440.50 g/mol. Its IUPAC name is 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide
PubChem CID55388331
Molecular FormulaC26H24N4O3
Molecular Weight440.50 g/mol
Exact Mass440.18
IUPAC Name1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide
SMILESCOc1ccc(C)cc1N1CC(C(=O)Nc2c(-c3ccccc3)nc3ccccn23)CC1=O
InChIInChI=1S/C26H24N4O3/c1-17-11-12-21(33-2)20(14-17)30-16-19(15-23(30)31)26(32)28-25-24(18-8-4-3-5-9-18)27-22-10-6-7-13-29(22)25/h3-14,19H,15-16H2,1-2H3,(H,28,32)
InChIKeyRYAFCZDZTWFLOL-UHFFFAOYSA-N
XLogP4.31
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.50
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methoxy-5-methylphenyl)-N-[4-(5-methyl-2-phenyl-1,3-thiazol-4-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 108810579
(3S)-1-(2-methoxy-5-methylphenyl)-5-oxo-N-quinolin-8-ylpyrrolidine-3-carboxamide
CID 9107582
N-(2,6-dichlorophenyl)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 113188236
(3R)-N-[(3R)-2,3-dimethyl-3,4-dihydropyrazol-5-yl]-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 97339337
N-(2-hydroxy-5-methylphenyl)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 108801213
(3R)-N-(2-methoxy-5-methylphenyl)-1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9098300
1-(2-methoxy-5-methylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 17191964
(3R)-1-(2-methoxy-5-methylphenyl)-5-oxo-N-pyridin-3-ylpyrrolidine-3-carboxamide
CID 40991014
N-[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]cyclohexanecarboxamide
CID 42693768
(3S)-1-(2-methoxy-5-methylphenyl)-N-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 94179751
(3S)-N-(2-chloro-4-methylphenyl)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 8885963
2-[3-[[(3R)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]pyrazol-1-yl]acetic acid
CID 125132512

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide (CID 55388331) is 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide is COc1ccc(C)cc1N1CC(C(=O)Nc2c(-c3ccccc3)nc3ccccn23)CC1=O.
What is the InChIKey of 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide?
The InChIKey is RYAFCZDZTWFLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O3/c1-17-11-12-21(33-2)20(14-17)30-16-19(15-23(30)31)26(32)28-25-24(18-8-4-3-5-9-18)27-22-10-6-7-13-29(22)25/h3-14,19H,15-16H2,1-2H3,(H,28,32).
What are the key properties of 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide?
1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide has a molecular weight of 440.50 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-methylphenyl)-5-oxo-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 55388331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).