6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione

C15H24N4O3 — CID 2441153

IUPAC6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione
SMILESCCCn1c(N)c(C(=O)CN2CCCCC2)c(=O)n(C)c1=O
InChIInChI=1S/C15H24N4O3/c1-3-7-19-13(16)12(14(21)17(2)15(19)22)11(20)10-18-8-5-4-6-9-18/h3-10,16H2,1-2H3
InChIKeyFFAWSQXYMFMSCM-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.21
Rot. Bonds5

About 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione

6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione (PubChem CID 2441153) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione
PubChem CID2441153
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC Name6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione
SMILESCCCn1c(N)c(C(=O)CN2CCCCC2)c(=O)n(C)c1=O
InChIInChI=1S/C15H24N4O3/c1-3-7-19-13(16)12(14(21)17(2)15(19)22)11(20)10-18-8-5-4-6-9-18/h3-10,16H2,1-2H3
InChIKeyFFAWSQXYMFMSCM-UHFFFAOYSA-N
XLogP0.21
TPSA90.33 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione (CID 2441153) is 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione is CCCn1c(N)c(C(=O)CN2CCCCC2)c(=O)n(C)c1=O.
What is the InChIKey of 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione?
The InChIKey is FFAWSQXYMFMSCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-3-7-19-13(16)12(14(21)17(2)15(19)22)11(20)10-18-8-5-4-6-9-18/h3-10,16H2,1-2H3.
What are the key properties of 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione?
6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione has a molecular weight of 308.38 g/mol, XLogP of 0.21, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-methyl-5-(2-piperidin-1-ylacetyl)-1-propylpyrimidine-2,4-dione is sourced from PubChem (CID 2441153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).