2-(2,4-dioxoquinazolin-1-yl)acetamide

C10H9N3O3 — CID 155322960

IUPAC2-(2,4-dioxoquinazolin-1-yl)acetamide
SMILESNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21
InChIInChI=1S/C10H9N3O3/c11-8(14)5-13-7-4-2-1-3-6(7)9(15)12-10(13)16/h1-4H,5H2,(H2,11,14)(H,12,15,16)
InChIKeyPASNNHJQRDJDPU-UHFFFAOYSA-N
MW219.20 g/mol
LogP-0.82
Rot. Bonds2

About 2-(2,4-dioxoquinazolin-1-yl)acetamide

2-(2,4-dioxoquinazolin-1-yl)acetamide (PubChem CID 155322960) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is 2-(2,4-dioxoquinazolin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dioxoquinazolin-1-yl)acetamide
PubChem CID155322960
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC Name2-(2,4-dioxoquinazolin-1-yl)acetamide
SMILESNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21
InChIInChI=1S/C10H9N3O3/c11-8(14)5-13-7-4-2-1-3-6(7)9(15)12-10(13)16/h1-4H,5H2,(H2,11,14)(H,12,15,16)
InChIKeyPASNNHJQRDJDPU-UHFFFAOYSA-N
XLogP-0.82
TPSA97.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-oxo-2-piperidin-1-ylethyl)quinazoline-2,4-dione
CID 36865914
1-[2-(azocan-1-yl)-2-oxoethyl]quinazoline-2,4-dione
CID 17437474
1-ethylquinazoline-2,4-dione
CID 825310
3-(2,4-dioxoquinazolin-1-yl)propanehydrazide
CID 818053
1-(5-chloropentyl)quinazoline-2,4-dione
CID 22449700
N-[1-(aminomethyl)cyclopentyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide
CID 119566494
ethyl 4-(2,4-dioxoquinazolin-1-yl)butanoate
CID 19087677
1-[2-(4,4-difluoro-3-methylpiperidin-1-yl)-2-oxoethyl]quinazoline-2,4-dione
CID 154738311
N-[1-(aminomethyl)cyclopentyl]-3-(2,4-dioxoquinazolin-1-yl)propanamide;hydrochloride
CID 119566493
1-[(4-chlorophenyl)methyl]quinazoline-2,4-dione
CID 19744058
(4-iodophenyl) 3-(2,4-dioxoquinazolin-1-yl)propanoate
CID 47015427
1-[2-(4,4-dimethyl-3-phenylpiperidin-1-yl)-2-oxoethyl]quinazoline-2,4-dione
CID 154850217

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxoquinazolin-1-yl)acetamide?
The IUPAC name of 2-(2,4-dioxoquinazolin-1-yl)acetamide (CID 155322960) is 2-(2,4-dioxoquinazolin-1-yl)acetamide.
What is the SMILES notation for 2-(2,4-dioxoquinazolin-1-yl)acetamide?
The canonical SMILES for 2-(2,4-dioxoquinazolin-1-yl)acetamide is NC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21.
What is the InChIKey of 2-(2,4-dioxoquinazolin-1-yl)acetamide?
The InChIKey is PASNNHJQRDJDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c11-8(14)5-13-7-4-2-1-3-6(7)9(15)12-10(13)16/h1-4H,5H2,(H2,11,14)(H,12,15,16).
What are the key properties of 2-(2,4-dioxoquinazolin-1-yl)acetamide?
2-(2,4-dioxoquinazolin-1-yl)acetamide has a molecular weight of 219.20 g/mol, XLogP of -0.82, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxoquinazolin-1-yl)acetamide is sourced from PubChem (CID 155322960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).