N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide

C10H13N5O4 — CID 171383949

IUPACN-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1nc(NC(C)=O)c(NC(C)=O)c(=O)[nH]1
InChIInChI=1S/C10H13N5O4/c1-4(16)11-7-8(12-5(2)17)14-10(13-6(3)18)15-9(7)19/h1-3H3,(H,11,16)(H3,12,13,14,15,17,18,19)
InChIKeyKRVPBDWFPQOOBA-UHFFFAOYSA-N
MW267.25 g/mol
LogP-0.35
Rot. Bonds3

About N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide

N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide (PubChem CID 171383949) has the molecular formula C10H13N5O4 and a molecular weight of 267.25 g/mol. Its IUPAC name is N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide
PubChem CID171383949
Molecular FormulaC10H13N5O4
Molecular Weight267.25 g/mol
Exact Mass267.10
IUPAC NameN-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1nc(NC(C)=O)c(NC(C)=O)c(=O)[nH]1
InChIInChI=1S/C10H13N5O4/c1-4(16)11-7-8(12-5(2)17)14-10(13-6(3)18)15-9(7)19/h1-3H3,(H,11,16)(H3,12,13,14,15,17,18,19)
InChIKeyKRVPBDWFPQOOBA-UHFFFAOYSA-N
XLogP-0.35
TPSA133.05 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 5-0.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide?
The IUPAC name of N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide (CID 171383949) is N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide?
The canonical SMILES for N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide is CC(=O)Nc1nc(NC(C)=O)c(NC(C)=O)c(=O)[nH]1.
What is the InChIKey of N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide?
The InChIKey is KRVPBDWFPQOOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O4/c1-4(16)11-7-8(12-5(2)17)14-10(13-6(3)18)15-9(7)19/h1-3H3,(H,11,16)(H3,12,13,14,15,17,18,19).
What are the key properties of N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide?
N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide has a molecular weight of 267.25 g/mol, XLogP of -0.35, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-diacetamido-6-oxo-1H-pyrimidin-5-yl)acetamide is sourced from PubChem (CID 171383949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).