1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one

C14H24N2O — CID 139400228

IUPAC1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one
SMILESC=C1CC(C)CC(CC)(CN2CCNC2=O)C1
InChIInChI=1S/C14H24N2O/c1-4-14(8-11(2)7-12(3)9-14)10-16-6-5-15-13(16)17/h12H,2,4-10H2,1,3H3,(H,15,17)
InChIKeyFALTYYUXKIAWEM-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.78
Rot. Bonds3

About 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one

1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one (PubChem CID 139400228) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one
PubChem CID139400228
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one
SMILESC=C1CC(C)CC(CC)(CN2CCNC2=O)C1
InChIInChI=1S/C14H24N2O/c1-4-14(8-11(2)7-12(3)9-14)10-16-6-5-15-13(16)17/h12H,2,4-10H2,1,3H3,(H,15,17)
InChIKeyFALTYYUXKIAWEM-UHFFFAOYSA-N
XLogP2.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1-ethyl-3-methyl-5-methylidenecyclohexyl)methanamine
CID 170198039
1-ethyl-3-methyl-5-methylidene-1-(2-methylpropyl)cyclohexane
CID 144560661
1-ethyl-3-methyl-1-(3-methylbutan-2-yloxymethyl)-5-methylidenecyclohexane
CID 129164282
1-[(1-hydroxy-3-methylcyclohexyl)methyl]imidazolidin-2-one
CID 115370735
1-ethylimidazolidin-2-one;hydrochloride
CID 21472714
1-[(4-methylcyclohexyl)methyl]imidazolidin-2-one
CID 115370654
ethane;ethene;1,1,3-trimethyl-5-methylidenecyclohexane
CID 142048618
1-[(1-hydroxy-4-methylcyclohexyl)methyl]-1,3-diazinan-2-one
CID 115371207
1-(2-methylprop-2-enyl)imidazolidin-2-one
CID 114619407
1-ethylimidazolidin-2-one;2-methylprop-2-enamide
CID 66716042
1-[(3-aminocyclobutyl)methyl]imidazolidin-2-one
CID 164654395
1-[(4-aminooxan-4-yl)methyl]imidazolidin-2-one
CID 164645078

Frequently Asked Questions

What is the IUPAC name of 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one?
The IUPAC name of 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one (CID 139400228) is 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one.
What is the SMILES notation for 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one?
The canonical SMILES for 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one is C=C1CC(C)CC(CC)(CN2CCNC2=O)C1.
What is the InChIKey of 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one?
The InChIKey is FALTYYUXKIAWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-14(8-11(2)7-12(3)9-14)10-16-6-5-15-13(16)17/h12H,2,4-10H2,1,3H3,(H,15,17).
What are the key properties of 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one?
1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one has a molecular weight of 236.36 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-ethyl-3-methyl-5-methylidenecyclohexyl)methyl]imidazolidin-2-one is sourced from PubChem (CID 139400228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).