5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one

C19H24N4O2 — CID 11371220

IUPAC5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one
SMILESO=c1ccc(-c2cnc(OC3CCN(C4CCCC4)CC3)nc2)c[nH]1
InChIInChI=1S/C19H24N4O2/c24-18-6-5-14(11-20-18)15-12-21-19(22-13-15)25-17-7-9-23(10-8-17)16-3-1-2-4-16/h5-6,11-13,16-17H,1-4,7-10H2,(H,20,24)
InChIKeyHUUAQDXCIIIHGB-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.62
Rot. Bonds4

About 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one

5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one (PubChem CID 11371220) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one
PubChem CID11371220
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one
SMILESO=c1ccc(-c2cnc(OC3CCN(C4CCCC4)CC3)nc2)c[nH]1
InChIInChI=1S/C19H24N4O2/c24-18-6-5-14(11-20-18)15-12-21-19(22-13-15)25-17-7-9-23(10-8-17)16-3-1-2-4-16/h5-6,11-13,16-17H,1-4,7-10H2,(H,20,24)
InChIKeyHUUAQDXCIIIHGB-UHFFFAOYSA-N
XLogP2.62
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one?
The IUPAC name of 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one (CID 11371220) is 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one?
The canonical SMILES for 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one is O=c1ccc(-c2cnc(OC3CCN(C4CCCC4)CC3)nc2)c[nH]1.
What is the InChIKey of 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one?
The InChIKey is HUUAQDXCIIIHGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-18-6-5-14(11-20-18)15-12-21-19(22-13-15)25-17-7-9-23(10-8-17)16-3-1-2-4-16/h5-6,11-13,16-17H,1-4,7-10H2,(H,20,24).
What are the key properties of 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one?
5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one has a molecular weight of 340.43 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1-cyclopentylpiperidin-4-yl)oxypyrimidin-5-yl]-1H-pyridin-2-one is sourced from PubChem (CID 11371220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).