3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one

C9H16N2O — CID 83250904

IUPAC3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NCN(CC2CC2)C1=O
InChIInChI=1S/C9H16N2O/c1-2-8-9(12)11(6-10-8)5-7-3-4-7/h7-8,10H,2-6H2,1H3
InChIKeyHDKLJRKVNLMJNU-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.56
Rot. Bonds3

About 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one

3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one (PubChem CID 83250904) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one.

Molecular Properties

Compound Name3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
PubChem CID83250904
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NCN(CC2CC2)C1=O
InChIInChI=1S/C9H16N2O/c1-2-8-9(12)11(6-10-8)5-7-3-4-7/h7-8,10H,2-6H2,1H3
InChIKeyHDKLJRKVNLMJNU-UHFFFAOYSA-N
XLogP0.56
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butyl-3-(cyclopropylmethyl)imidazolidin-4-one
CID 83251591
5-butyl-3-(cyclobutylmethyl)imidazolidin-4-one
CID 83244571
3-butyl-5-ethylimidazolidin-4-one
CID 83238020
5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one
CID 107416078
3-[2-(dimethylamino)ethyl]-5-ethylimidazolidin-4-one
CID 83251000
3-ethyl-1-(oxan-4-ylmethyl)piperazin-2-one
CID 63602279
5-ethyl-3-(2-methoxyethyl)imidazolidin-4-one
CID 83242628
5-ethyl-3-(3-methyl-2-propan-2-ylbutyl)imidazolidin-4-one
CID 102916025
3-ethyl-1-[(4-ethylcyclohexyl)methyl]-1,4-diazepane-2,5-dione
CID 64968269
5-butan-2-yl-3-[(4-methylcyclohexyl)methyl]imidazolidin-4-one
CID 83254446
3-[2-[di(propan-2-yl)amino]ethyl]-5-ethylimidazolidin-4-one
CID 83237576
3-ethyl-1-[(1-methylpiperidin-4-yl)methyl]piperazine-2,5-dione
CID 64966881

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
The IUPAC name of 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one (CID 83250904) is 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one.
What is the SMILES notation for 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
The canonical SMILES for 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one is CCC1NCN(CC2CC2)C1=O.
What is the InChIKey of 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
The InChIKey is HDKLJRKVNLMJNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-2-8-9(12)11(6-10-8)5-7-3-4-7/h7-8,10H,2-6H2,1H3.
What are the key properties of 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one has a molecular weight of 168.24 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one is sourced from PubChem (CID 83250904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).