6-hydroxy-1-methylpyrimidine-2,4-dione

C5H6N2O3 — CID 736435

IUPAC6-hydroxy-1-methylpyrimidine-2,4-dione
SMILESCn1c(O)cc(=O)[nH]c1=O
InChIInChI=1S/C5H6N2O3/c1-7-4(9)2-3(8)6-5(7)10/h2,9H,1H3,(H,6,8,10)
InChIKeyHUMSUAIRAJXARC-UHFFFAOYSA-N
MW142.11 g/mol
LogP-1.22
Rot. Bonds

About 6-hydroxy-1-methylpyrimidine-2,4-dione

6-hydroxy-1-methylpyrimidine-2,4-dione (PubChem CID 736435) has the molecular formula C5H6N2O3 and a molecular weight of 142.11 g/mol. Its IUPAC name is 6-hydroxy-1-methylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-1-methylpyrimidine-2,4-dione
PubChem CID736435
Molecular FormulaC5H6N2O3
Molecular Weight142.11 g/mol
Exact Mass142.04
IUPAC Name6-hydroxy-1-methylpyrimidine-2,4-dione
SMILESCn1c(O)cc(=O)[nH]c1=O
InChIInChI=1S/C5H6N2O3/c1-7-4(9)2-3(8)6-5(7)10/h2,9H,1H3,(H,6,8,10)
InChIKeyHUMSUAIRAJXARC-UHFFFAOYSA-N
XLogP-1.22
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.11
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

CID 81152
CID 81152
CID 12009
CID 12009
CID 96141
CID 96141
CID 4183135
CID 4183135
CID 75520
CID 75520
CID 104562
CID 104562
CID 853899
CID 853899
CID 2262138
CID 2262138
CID 513624
CID 513624
CID 2428996
CID 2428996
CID 652709
CID 652709
CID 208117
CID 208117

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-1-methylpyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-1-methylpyrimidine-2,4-dione (CID 736435) is 6-hydroxy-1-methylpyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-1-methylpyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-1-methylpyrimidine-2,4-dione is Cn1c(O)cc(=O)[nH]c1=O.
What is the InChIKey of 6-hydroxy-1-methylpyrimidine-2,4-dione?
The InChIKey is HUMSUAIRAJXARC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O3/c1-7-4(9)2-3(8)6-5(7)10/h2,9H,1H3,(H,6,8,10).
What are the key properties of 6-hydroxy-1-methylpyrimidine-2,4-dione?
6-hydroxy-1-methylpyrimidine-2,4-dione has a molecular weight of 142.11 g/mol, XLogP of -1.22, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-1-methylpyrimidine-2,4-dione is sourced from PubChem (CID 736435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).