2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide

C6H8N4O3 — CID 174382120

IUPAC2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide
SMILESNC(=O)C(N)n1ccc(=O)[nH]c1=O
InChIInChI=1S/C6H8N4O3/c7-4(5(8)12)10-2-1-3(11)9-6(10)13/h1-2,4H,7H2,(H2,8,12)(H,9,11,13)
InChIKeyBKRNTWKNYDQXQH-UHFFFAOYSA-N
MW184.16 g/mol
LogP-2.52
Rot. Bonds2

About 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide

2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide (PubChem CID 174382120) has the molecular formula C6H8N4O3 and a molecular weight of 184.16 g/mol. Its IUPAC name is 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound Name2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide
PubChem CID174382120
Molecular FormulaC6H8N4O3
Molecular Weight184.16 g/mol
Exact Mass184.06
IUPAC Name2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide
SMILESNC(=O)C(N)n1ccc(=O)[nH]c1=O
InChIInChI=1S/C6H8N4O3/c7-4(5(8)12)10-2-1-3(11)9-6(10)13/h1-2,4H,7H2,(H2,8,12)(H,9,11,13)
InChIKeyBKRNTWKNYDQXQH-UHFFFAOYSA-N
XLogP-2.52
TPSA123.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.16
LogP ≤ 5-2.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide?
The IUPAC name of 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide (CID 174382120) is 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide.
What is the SMILES notation for 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide?
The canonical SMILES for 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide is NC(=O)C(N)n1ccc(=O)[nH]c1=O.
What is the InChIKey of 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide?
The InChIKey is BKRNTWKNYDQXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O3/c7-4(5(8)12)10-2-1-3(11)9-6(10)13/h1-2,4H,7H2,(H2,8,12)(H,9,11,13).
What are the key properties of 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide?
2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide has a molecular weight of 184.16 g/mol, XLogP of -2.52, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2,4-dioxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 174382120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).