3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide

C24H19N5O3 — CID 24598058

IUPAC3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide
SMILESO=C(CCn1c(=O)[nH]c(=O)c2ccccc21)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C24H19N5O3/c30-22(12-14-29-20-6-2-1-5-18(20)23(31)27-24(29)32)25-17-10-8-16(9-11-17)19-15-28-13-4-3-7-21(28)26-19/h1-11,13,15H,12,14H2,(H,25,30)(H,27,31,32)
InChIKeyLJGQBAUGKFMELL-UHFFFAOYSA-N
MW425.45 g/mol
LogP3.03
Rot. Bonds5

About 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide

3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide (PubChem CID 24598058) has the molecular formula C24H19N5O3 and a molecular weight of 425.45 g/mol. Its IUPAC name is 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide.

Molecular Properties

Compound Name3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide
PubChem CID24598058
Molecular FormulaC24H19N5O3
Molecular Weight425.45 g/mol
Exact Mass425.15
IUPAC Name3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide
SMILESO=C(CCn1c(=O)[nH]c(=O)c2ccccc21)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C24H19N5O3/c30-22(12-14-29-20-6-2-1-5-18(20)23(31)27-24(29)32)25-17-10-8-16(9-11-17)19-15-28-13-4-3-7-21(28)26-19/h1-11,13,15H,12,14H2,(H,25,30)(H,27,31,32)
InChIKeyLJGQBAUGKFMELL-UHFFFAOYSA-N
XLogP3.03
TPSA101.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.45
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide?
The IUPAC name of 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide (CID 24598058) is 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide.
What is the SMILES notation for 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide?
The canonical SMILES for 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide is O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)Nc1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide?
The InChIKey is LJGQBAUGKFMELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5O3/c30-22(12-14-29-20-6-2-1-5-18(20)23(31)27-24(29)32)25-17-10-8-16(9-11-17)19-15-28-13-4-3-7-21(28)26-19/h1-11,13,15H,12,14H2,(H,25,30)(H,27,31,32).
What are the key properties of 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide?
3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide has a molecular weight of 425.45 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dioxoquinazolin-1-yl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide is sourced from PubChem (CID 24598058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).