1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one

C12H23N3O — CID 116979133

IUPAC1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one
SMILESCCCC1CN(CC2CCCCN2)C(=O)N1
InChIInChI=1S/C12H23N3O/c1-2-5-11-9-15(12(16)14-11)8-10-6-3-4-7-13-10/h10-11,13H,2-9H2,1H3,(H,14,16)
InChIKeyFMEGNEMHSNLQNH-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.32
Rot. Bonds4

About 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one

1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one (PubChem CID 116979133) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one.

Molecular Properties

Compound Name1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one
PubChem CID116979133
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one
SMILESCCCC1CN(CC2CCCCN2)C(=O)N1
InChIInChI=1S/C12H23N3O/c1-2-5-11-9-15(12(16)14-11)8-10-6-3-4-7-13-10/h10-11,13H,2-9H2,1H3,(H,14,16)
InChIKeyFMEGNEMHSNLQNH-UHFFFAOYSA-N
XLogP1.32
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-piperidin-2-ylethyl)-4-propylimidazolidin-2-one
CID 116980617
4-(1-methylpyrrolidin-3-yl)-1-(piperidin-2-ylmethyl)imidazolidin-2-one
CID 116979152
azane;2-propylpiperidine
CID 156844924
4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one
CID 63104427
4-tert-butyl-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
CID 116979067
1-(piperidin-2-ylmethyl)-4-pyridin-4-ylimidazolidin-2-one
CID 116979146
4-cyclopentyl-3-methyl-1-(piperidin-2-ylmethyl)imidazolidin-2-one
CID 116981839
4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
CID 116979093
1-(3-hydroxypropyl)-4-propylimidazolidin-2-one
CID 116979406
ethane;2-propylpyrrolidine
CID 143349498
ethane;(2R)-2-propylpyrrolidine
CID 155717204
1-(3-oxobutyl)-4-propylimidazolidin-2-one
CID 116980526

Frequently Asked Questions

What is the IUPAC name of 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one?
The IUPAC name of 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one (CID 116979133) is 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one.
What is the SMILES notation for 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one?
The canonical SMILES for 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one is CCCC1CN(CC2CCCCN2)C(=O)N1.
What is the InChIKey of 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one?
The InChIKey is FMEGNEMHSNLQNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-2-5-11-9-15(12(16)14-11)8-10-6-3-4-7-13-10/h10-11,13H,2-9H2,1H3,(H,14,16).
What are the key properties of 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one?
1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one has a molecular weight of 225.34 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one is sourced from PubChem (CID 116979133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).