4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one

C14H26N4O — CID 116979093

IUPAC4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
SMILESCN1CCC(C2CN(CC3CCCN3)C(=O)N2)CC1
InChIInChI=1S/C14H26N4O/c1-17-7-4-11(5-8-17)13-10-18(14(19)16-13)9-12-3-2-6-15-12/h11-13,15H,2-10H2,1H3,(H,16,19)
InChIKeyBPYBGUULPJBDLP-UHFFFAOYSA-N
MW266.39 g/mol
LogP0.47
Rot. Bonds3

About 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one

4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one (PubChem CID 116979093) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
PubChem CID116979093
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
SMILESCN1CCC(C2CN(CC3CCCN3)C(=O)N2)CC1
InChIInChI=1S/C14H26N4O/c1-17-7-4-11(5-8-17)13-10-18(14(19)16-13)9-12-3-2-6-15-12/h11-13,15H,2-10H2,1H3,(H,16,19)
InChIKeyBPYBGUULPJBDLP-UHFFFAOYSA-N
XLogP0.47
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-methylpyrrolidin-3-yl)-1-(piperidin-2-ylmethyl)imidazolidin-2-one
CID 116979152
4-tert-butyl-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
CID 116979067
1-methyl-3-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
CID 62490301
methyl 2-[4-(1-methylpiperidin-4-yl)-2-oxoimidazolidin-1-yl]acetate
CID 116980345
1-(piperidin-2-ylmethyl)-4-propylimidazolidin-2-one
CID 116979133
3-methyl-1-[[(2R)-pyrrolidin-2-yl]methyl]piperidin-2-one
CID 102819920
4-(1-methylpyrrolidin-3-yl)-1-(morpholin-2-ylmethyl)imidazolidin-2-one
CID 116980702
4-cyclopentyl-3-methyl-1-(piperidin-2-ylmethyl)imidazolidin-2-one
CID 116981839
4-cyclohexyl-1-ethylimidazolidin-2-one
CID 89080819
1-(piperidin-2-ylmethyl)-4-pyridin-4-ylimidazolidin-2-one
CID 116979146
4-methyl-1-(piperidin-2-ylmethyl)pyrrolidin-2-one
CID 63104427
3,4-dimethyl-1-[[(2R)-pyrrolidin-2-yl]methyl]pyrrolidine-2,5-dione
CID 102819845

Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one?
The IUPAC name of 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one (CID 116979093) is 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one.
What is the SMILES notation for 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one?
The canonical SMILES for 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one is CN1CCC(C2CN(CC3CCCN3)C(=O)N2)CC1.
What is the InChIKey of 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one?
The InChIKey is BPYBGUULPJBDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-17-7-4-11(5-8-17)13-10-18(14(19)16-13)9-12-3-2-6-15-12/h11-13,15H,2-10H2,1H3,(H,16,19).
What are the key properties of 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one?
4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one has a molecular weight of 266.39 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpiperidin-4-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one is sourced from PubChem (CID 116979093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).