6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione

C9H14N2O2 — CID 13029752

IUPAC6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione
SMILESCCc1c(C)c(=O)n(C)c(=O)n1C
InChIInChI=1S/C9H14N2O2/c1-5-7-6(2)8(12)11(4)9(13)10(7)3/h5H2,1-4H3
InChIKeyAMLYHADAWVYYOY-UHFFFAOYSA-N
MW182.22 g/mol
LogP-0.05
Rot. Bonds1

About 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione

6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione (PubChem CID 13029752) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione
PubChem CID13029752
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione
SMILESCCc1c(C)c(=O)n(C)c(=O)n1C
InChIInChI=1S/C9H14N2O2/c1-5-7-6(2)8(12)11(4)9(13)10(7)3/h5H2,1-4H3
InChIKeyAMLYHADAWVYYOY-UHFFFAOYSA-N
XLogP-0.05
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 5-0.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Uracil, 3,6-dimethyl-5-ethyl-
CID 3021669
1,3,5,6-Tetramethylpyrimidine-2,4(1H,3H)-dione
CID 13076782
1,5,6-Trimethyluracil
CID 22223251
pyrimidine-2,4(1H,3H)-dione, 5-ethyl-1-methyl-6-propyl-
CID 129939632
pyrimidine-2,4(1H,3H)-dione, 5-ethyl-3-methyl-6-propyl-
CID 130005194
6-Ethyl-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
CID 12955129
6-Iso-propyl-1,3-dimethyluracil
CID 58883363
2-[(1,3,4-Trimethyl-2,6-dioxopyrimidin-5-yl)methylidene]propanedinitrile
CID 398630
Ethane;1,3,5-trimethyl-6-(trifluoromethyl)pyrimidine-2,4-dione
CID 142067519
6-tert-butyl-3-methyl-1H-pyrimidine-2,4-dione
CID 824665
5-Amino-6-ethyl-1,3-dimethyluracil
CID 21685435
1,3-Dimethylcycloocta[d]pyrimidine-2,4-dione
CID 91279289

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione?
The IUPAC name of 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione (CID 13029752) is 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione?
The canonical SMILES for 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione is CCc1c(C)c(=O)n(C)c(=O)n1C.
What is the InChIKey of 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione?
The InChIKey is AMLYHADAWVYYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-5-7-6(2)8(12)11(4)9(13)10(7)3/h5H2,1-4H3.
What are the key properties of 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione?
6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione has a molecular weight of 182.22 g/mol, XLogP of -0.05, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1,3,5-trimethylpyrimidine-2,4-dione is sourced from PubChem (CID 13029752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).