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

C7H9N3O3 — CID 143790176

IUPAC2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide
SMILESCc1c(CC(N)=O)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H9N3O3/c1-3-4(2-5(8)11)9-7(13)10-6(3)12/h2H2,1H3,(H2,8,11)(H2,9,10,12,13)
InChIKeyHWOXHFNUZFJLPS-UHFFFAOYSA-N
MW183.17 g/mol
LogP-1.60
Rot. Bonds2

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

2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide (PubChem CID 143790176) has the molecular formula C7H9N3O3 and a molecular weight of 183.17 g/mol. Its IUPAC name is 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide
PubChem CID143790176
Molecular FormulaC7H9N3O3
Molecular Weight183.17 g/mol
Exact Mass183.06
IUPAC Name2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide
SMILESCc1c(CC(N)=O)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C7H9N3O3/c1-3-4(2-5(8)11)9-7(13)10-6(3)12/h2H2,1H3,(H2,8,11)(H2,9,10,12,13)
InChIKeyHWOXHFNUZFJLPS-UHFFFAOYSA-N
XLogP-1.60
TPSA108.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 5-1.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5,6-Dimethyluracil
CID 96031
Uracil, 5-ethyl-6-methyl-
CID 202538
5-Acetyl-6-methylpyrimidine-2,4(1H,3H)-dione
CID 7131306
Uracil, 3,6-dimethyl-5-ethyl-
CID 3021669
Uracil, 6-methyl-5-propyl-
CID 3025420
5-Amino-6-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 133630083
6-Ethyl-5-methyl-2,4(1H,3H)-pyrimidinedione
CID 14842377
Uracil, 5-(2-bromoethyl)-6-methyl-
CID 147314
6-methyl-5-propan-2-yl-1H-pyrimidine-2,4-dione
CID 12512057
Butylmethyl pyrimidinedione
CID 15721967
6-(1,1-difluoroethyl)-5-methyl-1H-pyrimidine-2,4-dione
CID 129278642
6-Ethyl-5-fluoro-2,4(1h,3h)-pyrimidinedione
CID 141860431

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
The IUPAC name of 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide (CID 143790176) is 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide.
What is the SMILES notation for 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
The canonical SMILES for 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide is Cc1c(CC(N)=O)[nH]c(=O)[nH]c1=O.
What is the InChIKey of 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
The InChIKey is HWOXHFNUZFJLPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3/c1-3-4(2-5(8)11)9-7(13)10-6(3)12/h2H2,1H3,(H2,8,11)(H2,9,10,12,13).
What are the key properties of 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide has a molecular weight of 183.17 g/mol, XLogP of -1.60, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2,4-dioxo-1H-pyrimidin-6-yl)acetamide is sourced from PubChem (CID 143790176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).