6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione

C11H18N4O4S — CID 7197645

IUPAC6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione
SMILESCn1c(N)c(S(=O)(=O)N2CCCCC2)c(=O)n(C)c1=O
InChIInChI=1S/C11H18N4O4S/c1-13-9(12)8(10(16)14(2)11(13)17)20(18,19)15-6-4-3-5-7-15/h3-7,12H2,1-2H3
InChIKeySVZNIPGSNAPFRD-UHFFFAOYSA-N
MW302.36 g/mol
LogP-1.16
Rot. Bonds2

About 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione

6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione (PubChem CID 7197645) has the molecular formula C11H18N4O4S and a molecular weight of 302.36 g/mol. Its IUPAC name is 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione
PubChem CID7197645
Molecular FormulaC11H18N4O4S
Molecular Weight302.36 g/mol
Exact Mass302.10
IUPAC Name6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione
SMILESCn1c(N)c(S(=O)(=O)N2CCCCC2)c(=O)n(C)c1=O
InChIInChI=1S/C11H18N4O4S/c1-13-9(12)8(10(16)14(2)11(13)17)20(18,19)15-6-4-3-5-7-15/h3-7,12H2,1-2H3
InChIKeySVZNIPGSNAPFRD-UHFFFAOYSA-N
XLogP-1.16
TPSA107.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.36
LogP ≤ 5-1.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione (CID 7197645) is 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione is Cn1c(N)c(S(=O)(=O)N2CCCCC2)c(=O)n(C)c1=O.
What is the InChIKey of 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione?
The InChIKey is SVZNIPGSNAPFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O4S/c1-13-9(12)8(10(16)14(2)11(13)17)20(18,19)15-6-4-3-5-7-15/h3-7,12H2,1-2H3.
What are the key properties of 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione?
6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione has a molecular weight of 302.36 g/mol, XLogP of -1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1,3-dimethyl-5-piperidin-1-ylsulfonylpyrimidine-2,4-dione is sourced from PubChem (CID 7197645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).