5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one

C14H26N2O — CID 114112419

IUPAC5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one
SMILESCCCCC1NC(C)N(C2CC2CCC)C1=O
InChIInChI=1S/C14H26N2O/c1-4-6-8-12-14(17)16(10(3)15-12)13-9-11(13)7-5-2/h10-13,15H,4-9H2,1-3H3
InChIKeyIYTRQMKZPQAGBC-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.51
Rot. Bonds6

About 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one

5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one (PubChem CID 114112419) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one
PubChem CID114112419
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one
SMILESCCCCC1NC(C)N(C2CC2CCC)C1=O
InChIInChI=1S/C14H26N2O/c1-4-6-8-12-14(17)16(10(3)15-12)13-9-11(13)7-5-2/h10-13,15H,4-9H2,1-3H3
InChIKeyIYTRQMKZPQAGBC-UHFFFAOYSA-N
XLogP2.51
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butyl-2-methyl-3-(2-methylcycloheptyl)imidazolidin-4-one
CID 83259175
5-butyl-2-methyl-3-(7-oxabicyclo[2.2.1]heptan-2-yl)imidazolidin-4-one
CID 83270218
3-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2-methyl-5-propylimidazolidin-4-one
CID 83249017
5-butyl-2-methyl-3-pentan-2-ylimidazolidin-4-one
CID 83239016
5-butyl-3-(cyclopropylmethyl)-2-methylimidazolidin-4-one
CID 83250992
5-butyl-3-(1-cyclopentylethyl)-2-methylimidazolidin-4-one
CID 83264217
5-butyl-2-methyl-3-(3-methylpentan-2-yl)imidazolidin-4-one
CID 83246045
5-butyl-2-cyclopentyl-3-(3-methylcyclopentyl)imidazolidin-4-one
CID 114552252
5-butyl-3-cyclooctyl-2-propylimidazolidin-4-one
CID 83238137
5-butyl-2-ethyl-3-(4-methylcyclohexyl)imidazolidin-4-one
CID 83238921
5-butyl-3-(3-ethyl-2-methylcyclopentyl)-2-propan-2-ylimidazolidin-4-one
CID 83266918
5-butyl-2-methyl-3-(4-methylhexan-2-yl)imidazolidin-4-one
CID 83264581

Frequently Asked Questions

What is the IUPAC name of 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one?
The IUPAC name of 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one (CID 114112419) is 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one.
What is the SMILES notation for 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one?
The canonical SMILES for 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one is CCCCC1NC(C)N(C2CC2CCC)C1=O.
What is the InChIKey of 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one?
The InChIKey is IYTRQMKZPQAGBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-4-6-8-12-14(17)16(10(3)15-12)13-9-11(13)7-5-2/h10-13,15H,4-9H2,1-3H3.
What are the key properties of 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one?
5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one has a molecular weight of 238.37 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-2-methyl-3-(2-propylcyclopropyl)imidazolidin-4-one is sourced from PubChem (CID 114112419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).