2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide

C14H24N4O3 — CID 63801340

IUPAC2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
SMILESCCCn1cc(N)c(=O)n(CC(=O)NC(C)C(C)C)c1=O
InChIInChI=1S/C14H24N4O3/c1-5-6-17-7-11(15)13(20)18(14(17)21)8-12(19)16-10(4)9(2)3/h7,9-10H,5-6,8,15H2,1-4H3,(H,16,19)
InChIKeyBWDNWLSLJCQLGS-UHFFFAOYSA-N
MW296.37 g/mol
LogP0.16
Rot. Bonds6

About 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide

2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide (PubChem CID 63801340) has the molecular formula C14H24N4O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
PubChem CID63801340
Molecular FormulaC14H24N4O3
Molecular Weight296.37 g/mol
Exact Mass296.18
IUPAC Name2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
SMILESCCCn1cc(N)c(=O)n(CC(=O)NC(C)C(C)C)c1=O
InChIInChI=1S/C14H24N4O3/c1-5-6-17-7-11(15)13(20)18(14(17)21)8-12(19)16-10(4)9(2)3/h7,9-10H,5-6,8,15H2,1-4H3,(H,16,19)
InChIKeyBWDNWLSLJCQLGS-UHFFFAOYSA-N
XLogP0.16
TPSA99.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide (CID 63801340) is 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide is CCCn1cc(N)c(=O)n(CC(=O)NC(C)C(C)C)c1=O.
What is the InChIKey of 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is BWDNWLSLJCQLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3/c1-5-6-17-7-11(15)13(20)18(14(17)21)8-12(19)16-10(4)9(2)3/h7,9-10H,5-6,8,15H2,1-4H3,(H,16,19).
What are the key properties of 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide?
2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 296.37 g/mol, XLogP of 0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 63801340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).