(3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

C25H22N4O2 — CID 122284903

IUPAC(3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1ccn2cc(-c3cccc(NC(=O)[C@H]4CC(=O)N(c5ccccc5)C4)c3)nc2c1
InChIInChI=1S/C25H22N4O2/c1-17-10-11-28-16-22(27-23(28)12-17)18-6-5-7-20(13-18)26-25(31)19-14-24(30)29(15-19)21-8-3-2-4-9-21/h2-13,16,19H,14-15H2,1H3,(H,26,31)/t19-/m0/s1
InChIKeyABOIMSRYLFFLJP-IBGZPJMESA-N
MW410.48 g/mol
LogP4.30
Rot. Bonds4

About (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

(3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 122284903) has the molecular formula C25H22N4O2 and a molecular weight of 410.48 g/mol. Its IUPAC name is (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID122284903
Molecular FormulaC25H22N4O2
Molecular Weight410.48 g/mol
Exact Mass410.17
IUPAC Name(3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1ccn2cc(-c3cccc(NC(=O)[C@H]4CC(=O)N(c5ccccc5)C4)c3)nc2c1
InChIInChI=1S/C25H22N4O2/c1-17-10-11-28-16-22(27-23(28)12-17)18-6-5-7-20(13-18)26-25(31)19-14-24(30)29(15-19)21-8-3-2-4-9-21/h2-13,16,19H,14-15H2,1H3,(H,26,31)/t19-/m0/s1
InChIKeyABOIMSRYLFFLJP-IBGZPJMESA-N
XLogP4.30
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.48
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 122285105
(3R)-N-(3-methylphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 878925
(E)-4-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-4-oxobut-2-enoic acid
CID 695183
N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 46687180
(3S)-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 122283561
(3S)-1-(3-acetamidophenyl)-N-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 92727129
(3S)-N-(3,5-dimethylphenyl)-1-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 93017598
2-(1,3-dioxoisoindol-2-yl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 122284914
1-(4-ethylphenyl)-N-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 3155517
N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 46292736
(3S)-N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 92746342
(3R)-N-[3-(2-methylpropanoylamino)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 7220564

Frequently Asked Questions

What is the IUPAC name of (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 122284903) is (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is Cc1ccn2cc(-c3cccc(NC(=O)[C@H]4CC(=O)N(c5ccccc5)C4)c3)nc2c1.
What is the InChIKey of (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is ABOIMSRYLFFLJP-IBGZPJMESA-N. The full InChI is InChI=1S/C25H22N4O2/c1-17-10-11-28-16-22(27-23(28)12-17)18-6-5-7-20(13-18)26-25(31)19-14-24(30)29(15-19)21-8-3-2-4-9-21/h2-13,16,19H,14-15H2,1H3,(H,26,31)/t19-/m0/s1.
What are the key properties of (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
(3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide has a molecular weight of 410.48 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 122284903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).