5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione

C10H16N2O2 — CID 130005194

IUPAC5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione
SMILESCCCc1[nH]c(=O)n(C)c(=O)c1CC
InChIInChI=1S/C10H16N2O2/c1-4-6-8-7(5-2)9(13)12(3)10(14)11-8/h4-6H2,1-3H3,(H,11,14)
InChIKeyWGAGJRFPEBHWIC-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.59
Rot. Bonds3

About 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione

5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione (PubChem CID 130005194) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione
PubChem CID130005194
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione
SMILESCCCc1[nH]c(=O)n(C)c(=O)c1CC
InChIInChI=1S/C10H16N2O2/c1-4-6-8-7(5-2)9(13)12(3)10(14)11-8/h4-6H2,1-3H3,(H,11,14)
InChIKeyWGAGJRFPEBHWIC-UHFFFAOYSA-N
XLogP0.59
TPSA54.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Uracil, 5-allyl-6-methyl-
CID 824910
3,5,6-Trimethyluracil
CID 98786
Uracil, 5-ethyl-6-methyl-
CID 202538
Uracil, 3,6-dimethyl-5-ethyl-
CID 3021669
Uracil, 6-methyl-5-propyl-
CID 3025420
Uracil, 5-butyl-6-ethyl-
CID 3062839
Uracil, 5-allyl-3,6-dimethyl-
CID 3021699
Uracil, 3,6-dimethyl-5-propyl-
CID 3021709
Uracil, 5-butyl-3,6-dimethyl-
CID 3021746
Uracil, 5-butyl-3-ethyl-6-methyl-
CID 3021772
5-Butyl-6-ethyl-3-methyluracil
CID 3021773
Uracil, 5-butyl-3-methyl-6-propyl-
CID 3021849

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione (CID 130005194) is 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione is CCCc1[nH]c(=O)n(C)c(=O)c1CC.
What is the InChIKey of 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione?
The InChIKey is WGAGJRFPEBHWIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-4-6-8-7(5-2)9(13)12(3)10(14)11-8/h4-6H2,1-3H3,(H,11,14).
What are the key properties of 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione?
5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione has a molecular weight of 196.25 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-6-propyl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 130005194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).