1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one

C10H19N3O — CID 54097904

IUPAC1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one
SMILESCC1(C)CN(CCN2CCNC2=O)C1
InChIInChI=1S/C10H19N3O/c1-10(2)7-12(8-10)5-6-13-4-3-11-9(13)14/h3-8H2,1-2H3,(H,11,14)
InChIKeyMYLKPHHAOOFJQP-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.35
Rot. Bonds3

About 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one

1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one (PubChem CID 54097904) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one
PubChem CID54097904
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one
SMILESCC1(C)CN(CCN2CCNC2=O)C1
InChIInChI=1S/C10H19N3O/c1-10(2)7-12(8-10)5-6-13-4-3-11-9(13)14/h3-8H2,1-2H3,(H,11,14)
InChIKeyMYLKPHHAOOFJQP-UHFFFAOYSA-N
XLogP0.35
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,4-Dimethyl-1-tert-butylimidazolidin-2-one
CID 6422222
1-[3-(Dimethylamino)propyl]imidazolidin-2-one
CID 17776604
1-Methyl-3-(3-(methylamino)propyl)imidazolidin-2-one hydrochloride
CID 154795316
1-Methyl-3-[3-(methylamino)propyl]imidazolidin-2-one
CID 62490655
1-tert-Butyl-5,5-dimethylimidazolidin-2-one
CID 328246
1-[2-(2-Oxoimidazolidin-1-yl)ethyl]-3-propylurea
CID 2811176
1-[3-(Dimethylamino)propyl]imidazolidin-2-one;hydrochloride
CID 17776603
1-(2-Aminoethyl)-3-propylimidazolidin-2-one
CID 20223599
1-(2-Aminoethyl)-3-butylimidazolidin-2-one
CID 20223605
1-[2-(Tert-butylamino)ethyl]imidazolidin-2-one
CID 20608644
4-Methyl-1-(2-methylpropyl)imidazolidin-2-one
CID 20771058
1-Propylimidazolidin-2-one
CID 21719016

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one (CID 54097904) is 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one is CC1(C)CN(CCN2CCNC2=O)C1.
What is the InChIKey of 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one?
The InChIKey is MYLKPHHAOOFJQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-10(2)7-12(8-10)5-6-13-4-3-11-9(13)14/h3-8H2,1-2H3,(H,11,14).
What are the key properties of 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one?
1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one has a molecular weight of 197.28 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3,3-dimethylazetidin-1-yl)ethyl]imidazolidin-2-one is sourced from PubChem (CID 54097904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).