6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione

C10H15N5O3 — CID 62059575

IUPAC6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione
SMILESCn1c(N)c(NC2CCCNC2=O)c(=O)[nH]c1=O
InChIInChI=1S/C10H15N5O3/c1-15-7(11)6(9(17)14-10(15)18)13-5-3-2-4-12-8(5)16/h5,13H,2-4,11H2,1H3,(H,12,16)(H,14,17,18)
InChIKeyUZYWFBZSHMHQCN-UHFFFAOYSA-N
MW253.26 g/mol
LogP-1.65
Rot. Bonds2

About 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione

6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione (PubChem CID 62059575) has the molecular formula C10H15N5O3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione
PubChem CID62059575
Molecular FormulaC10H15N5O3
Molecular Weight253.26 g/mol
Exact Mass253.12
IUPAC Name6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione
SMILESCn1c(N)c(NC2CCCNC2=O)c(=O)[nH]c1=O
InChIInChI=1S/C10H15N5O3/c1-15-7(11)6(9(17)14-10(15)18)13-5-3-2-4-12-8(5)16/h5,13H,2-4,11H2,1H3,(H,12,16)(H,14,17,18)
InChIKeyUZYWFBZSHMHQCN-UHFFFAOYSA-N
XLogP-1.65
TPSA122.01 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-1.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione (CID 62059575) is 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione is Cn1c(N)c(NC2CCCNC2=O)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione?
The InChIKey is UZYWFBZSHMHQCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3/c1-15-7(11)6(9(17)14-10(15)18)13-5-3-2-4-12-8(5)16/h5,13H,2-4,11H2,1H3,(H,12,16)(H,14,17,18).
What are the key properties of 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione?
6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione has a molecular weight of 253.26 g/mol, XLogP of -1.65, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-methyl-5-[(2-oxopiperidin-3-yl)amino]pyrimidine-2,4-dione is sourced from PubChem (CID 62059575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).