N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide

C19H18N4O4 — CID 4910445

IUPACN-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)n2c(=O)[nH]c3ccccc3c2=O)cc1
InChIInChI=1S/C19H18N4O4/c1-11(17(25)21-14-9-7-13(8-10-14)20-12(2)24)23-18(26)15-5-3-4-6-16(15)22-19(23)27/h3-11H,1-2H3,(H,20,24)(H,21,25)(H,22,27)
InChIKeyDOZZMTHHJRZHQJ-UHFFFAOYSA-N
MW366.38 g/mol
LogP1.85
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide

N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide (PubChem CID 4910445) has the molecular formula C19H18N4O4 and a molecular weight of 366.38 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
PubChem CID4910445
Molecular FormulaC19H18N4O4
Molecular Weight366.38 g/mol
Exact Mass366.13
IUPAC NameN-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
SMILESCC(=O)Nc1ccc(NC(=O)C(C)n2c(=O)[nH]c3ccccc3c2=O)cc1
InChIInChI=1S/C19H18N4O4/c1-11(17(25)21-14-9-7-13(8-10-14)20-12(2)24)23-18(26)15-5-3-4-6-16(15)22-19(23)27/h3-11H,1-2H3,(H,20,24)(H,21,25)(H,22,27)
InChIKeyDOZZMTHHJRZHQJ-UHFFFAOYSA-N
XLogP1.85
TPSA113.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.38
LogP ≤ 51.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-acetylphenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
CID 4911728
N-(4-butoxyphenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
CID 4909703
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(3-fluorophenyl)propanamide
CID 4902210
(2R)-2-[[(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanoyl]amino]-3-methylbutanoic acid
CID 51427958
(2S)-2-[[(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanoyl]amino]-2-phenylacetic acid
CID 51428003
N-(3-acetylphenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-methylbutanamide
CID 4904308
2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(4-pentylphenyl)propanamide
CID 42939385
2-(2,4-dioxo-1H-quinazolin-3-yl)-3-methylbutanoic acid
CID 15860182
N-(4-acetamidophenyl)-2-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 46301016
4-[[(2S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenylpropanoyl]amino]benzamide
CID 125431438
2-[[2-(2,4-dioxo-1H-quinazolin-3-yl)-3-methylbutanoyl]amino]propanoic acid
CID 4836848
4-[1-(2,4-dioxo-1H-quinazolin-3-yl)ethyl]benzoic acid
CID 66893674

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide (CID 4910445) is N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide is CC(=O)Nc1ccc(NC(=O)C(C)n2c(=O)[nH]c3ccccc3c2=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide?
The InChIKey is DOZZMTHHJRZHQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O4/c1-11(17(25)21-14-9-7-13(8-10-14)20-12(2)24)23-18(26)15-5-3-4-6-16(15)22-19(23)27/h3-11H,1-2H3,(H,20,24)(H,21,25)(H,22,27).
What are the key properties of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide?
N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide has a molecular weight of 366.38 g/mol, XLogP of 1.85, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)propanamide is sourced from PubChem (CID 4910445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).