3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one

C11H19N3O — CID 103125516

IUPAC3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one
SMILESCC(CN1CCCCC1)n1cc[nH]c1=O
InChIInChI=1S/C11H19N3O/c1-10(14-8-5-12-11(14)15)9-13-6-3-2-4-7-13/h5,8,10H,2-4,6-7,9H2,1H3,(H,12,15)
InChIKeyMFJDBCQIYKSKTN-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.22
Rot. Bonds3

About 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one

3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one (PubChem CID 103125516) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one.

Molecular Properties

Compound Name3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one
PubChem CID103125516
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one
SMILESCC(CN1CCCCC1)n1cc[nH]c1=O
InChIInChI=1S/C11H19N3O/c1-10(14-8-5-12-11(14)15)9-13-6-3-2-4-7-13/h5,8,10H,2-4,6-7,9H2,1H3,(H,12,15)
InChIKeyMFJDBCQIYKSKTN-UHFFFAOYSA-N
XLogP1.22
TPSA41.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-pent-4-yn-2-yl-1H-imidazol-2-one
CID 103124927
3-(1-cyclohexylethyl)-1H-imidazol-2-one
CID 103125595
1-[1-(azacyclotetradec-1-yl)propan-2-yl]-azacyclotetradecane
CID 69225763
5-ethyl-6-hydroxy-1-(1-piperidin-1-ylpropan-2-yl)pyrimidine-2,4-dione
CID 115947730
4-methyl-1-(1-piperidin-1-ylpropan-2-yl)imidazol-2-amine
CID 106569194
3-hex-5-yn-3-yl-1H-imidazol-2-one
CID 103124926
4-acetyl-1-(1-piperidin-1-ylpropan-2-yl)pyrrole-2-carboxylic acid
CID 114604416
(1R)-1-[3-(1-piperidin-1-ylpropan-2-yl)imidazol-4-yl]propan-1-amine
CID 104942805
2-(2-oxo-1H-imidazol-3-yl)butanoic acid
CID 66960784
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
2,5-dimethyl-3-(1-pyrrolidin-1-ylpropan-2-yl)imidazolidin-4-one
CID 83249326
N-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-2-amine
CID 106567606

Frequently Asked Questions

What is the IUPAC name of 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one?
The IUPAC name of 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one (CID 103125516) is 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one.
What is the SMILES notation for 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one?
The canonical SMILES for 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one is CC(CN1CCCCC1)n1cc[nH]c1=O.
What is the InChIKey of 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one?
The InChIKey is MFJDBCQIYKSKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-10(14-8-5-12-11(14)15)9-13-6-3-2-4-7-13/h5,8,10H,2-4,6-7,9H2,1H3,(H,12,15).
What are the key properties of 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one?
3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one has a molecular weight of 209.29 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-piperidin-1-ylpropan-2-yl)-1H-imidazol-2-one is sourced from PubChem (CID 103125516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).