5-methyl-5H-pyrimidine-2,4-dione

C5H6N2O2 — CID 15218620

IUPAC5-methyl-5H-pyrimidine-2,4-dione
SMILESCC1C=NC(=O)NC1=O
InChIInChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2-3H,1H3,(H,7,8,9)
InChIKeyUUHVJQQFVHPOGR-UHFFFAOYSA-N
MW126.11 g/mol
LogP-0.06
Rot. Bonds

About 5-methyl-5H-pyrimidine-2,4-dione

5-methyl-5H-pyrimidine-2,4-dione (PubChem CID 15218620) has the molecular formula C5H6N2O2 and a molecular weight of 126.11 g/mol. Its IUPAC name is 5-methyl-5H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-5H-pyrimidine-2,4-dione
PubChem CID15218620
Molecular FormulaC5H6N2O2
Molecular Weight126.11 g/mol
Exact Mass126.04
IUPAC Name5-methyl-5H-pyrimidine-2,4-dione
SMILESCC1C=NC(=O)NC1=O
InChIInChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2-3H,1H3,(H,7,8,9)
InChIKeyUUHVJQQFVHPOGR-UHFFFAOYSA-N
XLogP-0.06
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.11
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Pyrimidine-2,4(3H,5H)-dione
CID 15646795
5-iodo-5H-pyrimidine-2,4-dione
CID 72199443
Iminouracil
CID 129780322
5-Fluoro-2,4(3H,5H)-pyrimidinedione
CID 24870864
5-Fluoro-5-methyluracil
CID 4540465
(5S)-5-methyl-5H-pyrimidine-2,4-dione
CID 98455950
N-carbamoyl-3-imino-2-methylpropanamide
CID 91173470
5-Amino-5-methyluracil
CID 129865156
(5R)-5-fluoro-5-methylpyrimidine-2,4-dione
CID 7032788
(5S)-5-fluoro-5-methylpyrimidine-2,4-dione
CID 7032789
5-(Trifluoromethyl)pyrimidine-2,4(3H,5H)-dione
CID 46735517
(5R)-5-(trifluoromethyl)-5H-pyrimidine-2,4-dione
CID 98155753

Frequently Asked Questions

What is the IUPAC name of 5-methyl-5H-pyrimidine-2,4-dione?
The IUPAC name of 5-methyl-5H-pyrimidine-2,4-dione (CID 15218620) is 5-methyl-5H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-methyl-5H-pyrimidine-2,4-dione?
The canonical SMILES for 5-methyl-5H-pyrimidine-2,4-dione is CC1C=NC(=O)NC1=O.
What is the InChIKey of 5-methyl-5H-pyrimidine-2,4-dione?
The InChIKey is UUHVJQQFVHPOGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2-3H,1H3,(H,7,8,9).
What are the key properties of 5-methyl-5H-pyrimidine-2,4-dione?
5-methyl-5H-pyrimidine-2,4-dione has a molecular weight of 126.11 g/mol, XLogP of -0.06, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5H-pyrimidine-2,4-dione is sourced from PubChem (CID 15218620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).