5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione

C11H16N4O3 — CID 63800611

IUPAC5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione
SMILESCn1cc(N)c(=O)n(CC(=O)N2CCCC2)c1=O
InChIInChI=1S/C11H16N4O3/c1-13-6-8(12)10(17)15(11(13)18)7-9(16)14-4-2-3-5-14/h6H,2-5,7,12H2,1H3
InChIKeyQSMGMAFJPBEPGX-UHFFFAOYSA-N
MW252.27 g/mol
LogP-1.25
Rot. Bonds2

About 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione

5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione (PubChem CID 63800611) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione
PubChem CID63800611
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Name5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione
SMILESCn1cc(N)c(=O)n(CC(=O)N2CCCC2)c1=O
InChIInChI=1S/C11H16N4O3/c1-13-6-8(12)10(17)15(11(13)18)7-9(16)14-4-2-3-5-14/h6H,2-5,7,12H2,1H3
InChIKeyQSMGMAFJPBEPGX-UHFFFAOYSA-N
XLogP-1.25
TPSA90.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-1.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyridin-2-one
CID 97181448
4-methyl-2-(2-oxo-2-pyrrolidin-1-ylethyl)-1,2,4-triazol-3-one
CID 115774445
2-[2-(azepan-1-yl)-2-oxoethyl]-4-methyl-1,2,4-triazol-3-one
CID 113340196
6-amino-3-[2-(azepan-1-yl)-2-oxoethyl]-5-morpholin-4-yl-1-propylpyrimidine-2,4-dione
CID 9355179
1-cyclopropyl-2,4-dioxo-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-5-carbonitrile
CID 38670791
4-amino-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-pentylpyrrole-2-carbonitrile
CID 100768751
5-amino-1-methyl-3-(1-oxaspiro[4.4]nonan-2-ylmethyl)pyrimidine-2,4-dione
CID 102897966
6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)-3-propylquinazoline-2,4-dione
CID 71956368
3-(2-aminoethyl)-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione
CID 106934140
3,7-dimethyl-1-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]purine-2,6-dione
CID 155552199
4-amino-1-(2-oxo-2-piperidin-1-ylethyl)pyrazole-3-carboxylic acid
CID 107344226
5-amino-1-methyl-3-[(1-methyltriazol-4-yl)methyl]pyrimidine-2,4-dione
CID 107042848

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione?
The IUPAC name of 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione (CID 63800611) is 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione?
The canonical SMILES for 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione is Cn1cc(N)c(=O)n(CC(=O)N2CCCC2)c1=O.
What is the InChIKey of 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione?
The InChIKey is QSMGMAFJPBEPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c1-13-6-8(12)10(17)15(11(13)18)7-9(16)14-4-2-3-5-14/h6H,2-5,7,12H2,1H3.
What are the key properties of 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione?
5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione has a molecular weight of 252.27 g/mol, XLogP of -1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 63800611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).