5-methyl-1,3-dipropylpyrimidine-2,4-dione

C11H18N2O2 — CID 10727170

IUPAC5-methyl-1,3-dipropylpyrimidine-2,4-dione
SMILESCCCn1cc(C)c(=O)n(CCC)c1=O
InChIInChI=1S/C11H18N2O2/c1-4-6-12-8-9(3)10(14)13(7-5-2)11(12)15/h8H,4-7H2,1-3H3
InChIKeyOSDOPGJXAGSUEF-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.14
Rot. Bonds4

About 5-methyl-1,3-dipropylpyrimidine-2,4-dione

5-methyl-1,3-dipropylpyrimidine-2,4-dione (PubChem CID 10727170) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-methyl-1,3-dipropylpyrimidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-1,3-dipropylpyrimidine-2,4-dione
PubChem CID10727170
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name5-methyl-1,3-dipropylpyrimidine-2,4-dione
SMILESCCCn1cc(C)c(=O)n(CCC)c1=O
InChIInChI=1S/C11H18N2O2/c1-4-6-12-8-9(3)10(14)13(7-5-2)11(12)15/h8H,4-7H2,1-3H3
InChIKeyOSDOPGJXAGSUEF-UHFFFAOYSA-N
XLogP1.14
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,3-dipropylpyrimidine-2,4-dione?
The IUPAC name of 5-methyl-1,3-dipropylpyrimidine-2,4-dione (CID 10727170) is 5-methyl-1,3-dipropylpyrimidine-2,4-dione.
What is the SMILES notation for 5-methyl-1,3-dipropylpyrimidine-2,4-dione?
The canonical SMILES for 5-methyl-1,3-dipropylpyrimidine-2,4-dione is CCCn1cc(C)c(=O)n(CCC)c1=O.
What is the InChIKey of 5-methyl-1,3-dipropylpyrimidine-2,4-dione?
The InChIKey is OSDOPGJXAGSUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-4-6-12-8-9(3)10(14)13(7-5-2)11(12)15/h8H,4-7H2,1-3H3.
What are the key properties of 5-methyl-1,3-dipropylpyrimidine-2,4-dione?
5-methyl-1,3-dipropylpyrimidine-2,4-dione has a molecular weight of 210.28 g/mol, XLogP of 1.14, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,3-dipropylpyrimidine-2,4-dione is sourced from PubChem (CID 10727170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).