1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione

C8H13N3O2 — CID 822144

IUPAC1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione
SMILESCCn1c(NC)cc(=O)n(C)c1=O
InChIInChI=1S/C8H13N3O2/c1-4-11-6(9-2)5-7(12)10(3)8(11)13/h5,9H,4H2,1-3H3
InChIKeyLRZJTRMVLLHZBE-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.39
Rot. Bonds2

About 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione

1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione (PubChem CID 822144) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione
PubChem CID822144
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione
SMILESCCn1c(NC)cc(=O)n(C)c1=O
InChIInChI=1S/C8H13N3O2/c1-4-11-6(9-2)5-7(12)10(3)8(11)13/h5,9H,4H2,1-3H3
InChIKeyLRZJTRMVLLHZBE-UHFFFAOYSA-N
XLogP-0.39
TPSA56.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-Methyluracil
CID 79066
6-Amino-1,3-dimethyluracil
CID 81152
1-Methyluracil
CID 12009
6-Amino-3-methyl-1-(2-methyl-2-propen-1-yl)-2,4(1H,3H)-pyrimidinedione
CID 11071
6-Amino-1,3-dipropyluracil
CID 855055
Aminometradine
CID 12551
6-chloro-3-methylpyrimidine-2,4(1H,3H)-dione
CID 96141
1-Ethyluracil
CID 4183135
6-amino-1-isobutyl-3-methylpyrimidine-2,4(1H,3H)-dione
CID 250735
6-Amino-1-methyluracil
CID 75520
6-Amino-1-propyluracil
CID 104562
6-Amino-1-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 853899

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione?
The IUPAC name of 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione (CID 822144) is 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione.
What is the SMILES notation for 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione?
The canonical SMILES for 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione is CCn1c(NC)cc(=O)n(C)c1=O.
What is the InChIKey of 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione?
The InChIKey is LRZJTRMVLLHZBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-4-11-6(9-2)5-7(12)10(3)8(11)13/h5,9H,4H2,1-3H3.
What are the key properties of 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione?
1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione has a molecular weight of 183.21 g/mol, XLogP of -0.39, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-6-(methylamino)pyrimidine-2,4-dione is sourced from PubChem (CID 822144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).