N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide

C8H10N4O4 — CID 45071800

IUPACN-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1[nH]c(=O)[nH]c(=O)c1NC(C)=O
InChIInChI=1S/C8H10N4O4/c1-3(13)9-5-6(10-4(2)14)11-8(16)12-7(5)15/h1-2H3,(H,9,13)(H3,10,11,12,14,15,16)
InChIKeyCJCQUUZZHKEGSD-UHFFFAOYSA-N
MW226.19 g/mol
LogP-1.02
Rot. Bonds2

About N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide

N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide (PubChem CID 45071800) has the molecular formula C8H10N4O4 and a molecular weight of 226.19 g/mol. Its IUPAC name is N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound NameN-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
PubChem CID45071800
Molecular FormulaC8H10N4O4
Molecular Weight226.19 g/mol
Exact Mass226.07
IUPAC NameN-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1[nH]c(=O)[nH]c(=O)c1NC(C)=O
InChIInChI=1S/C8H10N4O4/c1-3(13)9-5-6(10-4(2)14)11-8(16)12-7(5)15/h1-2H3,(H,9,13)(H3,10,11,12,14,15,16)
InChIKeyCJCQUUZZHKEGSD-UHFFFAOYSA-N
XLogP-1.02
TPSA123.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.19
LogP ≤ 5-1.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide?
The IUPAC name of N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide (CID 45071800) is N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide?
The canonical SMILES for N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide is CC(=O)Nc1[nH]c(=O)[nH]c(=O)c1NC(C)=O.
What is the InChIKey of N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide?
The InChIKey is CJCQUUZZHKEGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O4/c1-3(13)9-5-6(10-4(2)14)11-8(16)12-7(5)15/h1-2H3,(H,9,13)(H3,10,11,12,14,15,16).
What are the key properties of N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide?
N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide has a molecular weight of 226.19 g/mol, XLogP of -1.02, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-acetamido-2,4-dioxo-1H-pyrimidin-5-yl)acetamide is sourced from PubChem (CID 45071800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).