5,6-diamino-1,3-dipropylpyrimidine-2,4-dione

C10H18N4O2 — CID 5098605

IUPAC5,6-diamino-1,3-dipropylpyrimidine-2,4-dione
SMILESCCCn1c(N)c(N)c(=O)n(CCC)c1=O
InChIInChI=1S/C10H18N4O2/c1-3-5-13-8(12)7(11)9(15)14(6-4-2)10(13)16/h3-6,11-12H2,1-2H3
InChIKeySVMBOONGPUFHRA-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.01
Rot. Bonds4

About 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione

5,6-diamino-1,3-dipropylpyrimidine-2,4-dione (PubChem CID 5098605) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione.

Molecular Properties

Compound Name5,6-diamino-1,3-dipropylpyrimidine-2,4-dione
PubChem CID5098605
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name5,6-diamino-1,3-dipropylpyrimidine-2,4-dione
SMILESCCCn1c(N)c(N)c(=O)n(CCC)c1=O
InChIInChI=1S/C10H18N4O2/c1-3-5-13-8(12)7(11)9(15)14(6-4-2)10(13)16/h3-6,11-12H2,1-2H3
InChIKeySVMBOONGPUFHRA-UHFFFAOYSA-N
XLogP-0.01
TPSA96.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5,6-diamino-1,3-dipropylpyrimidine-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 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione?
The IUPAC name of 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione (CID 5098605) is 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione.
What is the SMILES notation for 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione?
The canonical SMILES for 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione is CCCn1c(N)c(N)c(=O)n(CCC)c1=O.
What is the InChIKey of 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione?
The InChIKey is SVMBOONGPUFHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-3-5-13-8(12)7(11)9(15)14(6-4-2)10(13)16/h3-6,11-12H2,1-2H3.
What are the key properties of 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione?
5,6-diamino-1,3-dipropylpyrimidine-2,4-dione has a molecular weight of 226.28 g/mol, XLogP of -0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diamino-1,3-dipropylpyrimidine-2,4-dione is sourced from PubChem (CID 5098605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).