6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione

C15H18N4O2 — CID 662455

IUPAC6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione
SMILESNc1c(N2CCCCC2)c(=O)[nH]c(=O)n1-c1ccccc1
InChIInChI=1S/C15H18N4O2/c16-13-12(18-9-5-2-6-10-18)14(20)17-15(21)19(13)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,16H2,(H,17,20,21)
InChIKeyWEOANPSUSNCHBY-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.10
Rot. Bonds2

About 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione

6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione (PubChem CID 662455) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione
PubChem CID662455
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione
SMILESNc1c(N2CCCCC2)c(=O)[nH]c(=O)n1-c1ccccc1
InChIInChI=1S/C15H18N4O2/c16-13-12(18-9-5-2-6-10-18)14(20)17-15(21)19(13)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,16H2,(H,17,20,21)
InChIKeyWEOANPSUSNCHBY-UHFFFAOYSA-N
XLogP1.10
TPSA84.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione (CID 662455) is 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione is Nc1c(N2CCCCC2)c(=O)[nH]c(=O)n1-c1ccccc1.
What is the InChIKey of 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione?
The InChIKey is WEOANPSUSNCHBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c16-13-12(18-9-5-2-6-10-18)14(20)17-15(21)19(13)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,16H2,(H,17,20,21).
What are the key properties of 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione?
6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione has a molecular weight of 286.33 g/mol, XLogP of 1.10, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-phenyl-5-piperidin-1-ylpyrimidine-2,4-dione is sourced from PubChem (CID 662455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).