2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide

C20H27N5O3 — CID 3646370

IUPAC2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide
SMILESCCCn1c(N)c(N2CCCCC2)c(=O)n(CC(=O)Nc2ccccc2)c1=O
InChIInChI=1S/C20H27N5O3/c1-2-11-24-18(21)17(23-12-7-4-8-13-23)19(27)25(20(24)28)14-16(26)22-15-9-5-3-6-10-15/h3,5-6,9-10H,2,4,7-8,11-14,21H2,1H3,(H,22,26)
InChIKeyRNPZJAPHDAWHQG-UHFFFAOYSA-N
MW385.47 g/mol
LogP1.63
Rot. Bonds6

About 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide

2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide (PubChem CID 3646370) has the molecular formula C20H27N5O3 and a molecular weight of 385.47 g/mol. Its IUPAC name is 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide
PubChem CID3646370
Molecular FormulaC20H27N5O3
Molecular Weight385.47 g/mol
Exact Mass385.21
IUPAC Name2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide
SMILESCCCn1c(N)c(N2CCCCC2)c(=O)n(CC(=O)Nc2ccccc2)c1=O
InChIInChI=1S/C20H27N5O3/c1-2-11-24-18(21)17(23-12-7-4-8-13-23)19(27)25(20(24)28)14-16(26)22-15-9-5-3-6-10-15/h3,5-6,9-10H,2,4,7-8,11-14,21H2,1H3,(H,22,26)
InChIKeyRNPZJAPHDAWHQG-UHFFFAOYSA-N
XLogP1.63
TPSA102.36 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide?
The IUPAC name of 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide (CID 3646370) is 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide.
What is the SMILES notation for 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide?
The canonical SMILES for 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide is CCCn1c(N)c(N2CCCCC2)c(=O)n(CC(=O)Nc2ccccc2)c1=O.
What is the InChIKey of 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide?
The InChIKey is RNPZJAPHDAWHQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N5O3/c1-2-11-24-18(21)17(23-12-7-4-8-13-23)19(27)25(20(24)28)14-16(26)22-15-9-5-3-6-10-15/h3,5-6,9-10H,2,4,7-8,11-14,21H2,1H3,(H,22,26).
What are the key properties of 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide?
2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide has a molecular weight of 385.47 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2,6-dioxo-5-piperidin-1-yl-3-propylpyrimidin-1-yl)-N-phenylacetamide is sourced from PubChem (CID 3646370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).