1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one

C14H20N4O — CID 46881467

IUPAC1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one
SMILESO=C1N(CC2CCCCN2)CCN1c1cccnc1
InChIInChI=1S/C14H20N4O/c19-14-17(11-12-4-1-2-7-16-12)8-9-18(14)13-5-3-6-15-10-13/h3,5-6,10,12,16H,1-2,4,7-9,11H2
InChIKeyGDBWCGSXGHDTJU-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.47
Rot. Bonds3

About 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one

1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one (PubChem CID 46881467) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one
PubChem CID46881467
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one
SMILESO=C1N(CC2CCCCN2)CCN1c1cccnc1
InChIInChI=1S/C14H20N4O/c19-14-17(11-12-4-1-2-7-16-12)8-9-18(14)13-5-3-6-15-10-13/h3,5-6,10,12,16H,1-2,4,7-9,11H2
InChIKeyGDBWCGSXGHDTJU-UHFFFAOYSA-N
XLogP1.47
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Phenyl-1-(pyridin-3-yl)urea
CID 674807
1-(3-Fluorophenyl)-3-(3-pyridyl)urea
CID 853873
1-(Pyridin-3-yl)piperazine
CID 437234
1-Phenyl-3-(pyridin-2-ylmethyl)urea
CID 853198
N,N'-Di-4-pyridinylurea
CID 1082704
N-(pyridin-3-yl)indoline-1-carboxamide
CID 10823903
2-(Pyridin-3-yl)-2,5-diazabicyclo[2.2.1]heptane
CID 9837971
(1S,4S)-2-pyridin-3-yl-2,5-diazabicyclo[2.2.1]heptane
CID 16747994
(1R,4R)-2-pyridin-3-yl-2,5-diazabicyclo[2.2.1]heptane
CID 16748111
3-(Pyridin-3-YL)-3,8-diazabicyclo[3.2.1]octane
CID 45115751
1-Cyclohexyl-3-pyridin-3-ylurea
CID 721806
3H-Imidazo[4,5-c]pyridin-2-ol
CID 11686916

Frequently Asked Questions

What is the IUPAC name of 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one?
The IUPAC name of 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one (CID 46881467) is 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one.
What is the SMILES notation for 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one?
The canonical SMILES for 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one is O=C1N(CC2CCCCN2)CCN1c1cccnc1.
What is the InChIKey of 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one?
The InChIKey is GDBWCGSXGHDTJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c19-14-17(11-12-4-1-2-7-16-12)8-9-18(14)13-5-3-6-15-10-13/h3,5-6,10,12,16H,1-2,4,7-9,11H2.
What are the key properties of 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one?
1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one has a molecular weight of 260.34 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperidin-2-ylmethyl)-3-pyridin-3-ylimidazolidin-2-one is sourced from PubChem (CID 46881467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).