3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione

C15H23N3O2 — CID 4141058

IUPAC3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione
SMILESO=c1cc(N2CCCCC2)[nH]c(=O)n1C1CCCCC1
InChIInChI=1S/C15H23N3O2/c19-14-11-13(17-9-5-2-6-10-17)16-15(20)18(14)12-7-3-1-4-8-12/h11-12H,1-10H2,(H,16,20)
InChIKeyCASZZVGZZSFOLG-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.03
Rot. Bonds2

About 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione

3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione (PubChem CID 4141058) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione
PubChem CID4141058
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione
SMILESO=c1cc(N2CCCCC2)[nH]c(=O)n1C1CCCCC1
InChIInChI=1S/C15H23N3O2/c19-14-11-13(17-9-5-2-6-10-17)16-15(20)18(14)12-7-3-1-4-8-12/h11-12H,1-10H2,(H,16,20)
InChIKeyCASZZVGZZSFOLG-UHFFFAOYSA-N
XLogP2.03
TPSA58.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
The IUPAC name of 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione (CID 4141058) is 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione is O=c1cc(N2CCCCC2)[nH]c(=O)n1C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
The InChIKey is CASZZVGZZSFOLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c19-14-11-13(17-9-5-2-6-10-17)16-15(20)18(14)12-7-3-1-4-8-12/h11-12H,1-10H2,(H,16,20).
What are the key properties of 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione?
3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione has a molecular weight of 277.37 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-6-piperidin-1-yl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 4141058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).