2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one

C15H28N2O2 — CID 106011110

IUPAC2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one
SMILESCC(C)OCCCCN1C(=O)CNC1C1CCCC1
InChIInChI=1S/C15H28N2O2/c1-12(2)19-10-6-5-9-17-14(18)11-16-15(17)13-7-3-4-8-13/h12-13,15-16H,3-11H2,1-2H3
InChIKeyJMVDVABBXJRZPR-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.14
Rot. Bonds7

About 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one

2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one (PubChem CID 106011110) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one
PubChem CID106011110
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one
SMILESCC(C)OCCCCN1C(=O)CNC1C1CCCC1
InChIInChI=1S/C15H28N2O2/c1-12(2)19-10-6-5-9-17-14(18)11-16-15(17)13-7-3-4-8-13/h12-13,15-16H,3-11H2,1-2H3
InChIKeyJMVDVABBXJRZPR-UHFFFAOYSA-N
XLogP2.14
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopentyl-3-octylimidazolidin-4-one
CID 83260832
2-cyclopentyl-3-(3-methylsulfanylpropyl)imidazolidin-4-one
CID 83257328
2-cyclopentyl-3-(3-methylsulfinylpropyl)imidazolidin-4-one
CID 113488490
2-cyclopentyl-3-(2-fluoroethyl)imidazolidin-4-one
CID 130504754
2-cyclopentyl-3-(2-cyclopentyloxyethyl)imidazolidin-4-one
CID 83257002
2-cyclopentyl-3-(2-cyclopropylethyl)imidazolidin-4-one
CID 83258937
2-cyclopentyl-3-[2-[ethyl(methyl)amino]ethyl]imidazolidin-4-one
CID 83254712
6-cyclohexyl-1-(4-methoxybutyl)piperazine-2,5-dione
CID 104650445
2-cyclopentyl-3-(1-methoxypropan-2-yl)imidazolidin-4-one
CID 83238893
2-cyclopentyl-5-ethyl-5-methyl-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 104767617
5-methyl-6-(4-propan-2-yloxybutyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 114137001
2-(4-propan-2-yloxybutyl)-3,6,7,8,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione
CID 106009063

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one (CID 106011110) is 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one is CC(C)OCCCCN1C(=O)CNC1C1CCCC1.
What is the InChIKey of 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one?
The InChIKey is JMVDVABBXJRZPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(2)19-10-6-5-9-17-14(18)11-16-15(17)13-7-3-4-8-13/h12-13,15-16H,3-11H2,1-2H3.
What are the key properties of 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one?
2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one has a molecular weight of 268.40 g/mol, XLogP of 2.14, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-(4-propan-2-yloxybutyl)imidazolidin-4-one is sourced from PubChem (CID 106011110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).