3-pentan-2-yl-2,5-dipropylimidazolidin-4-one

C14H28N2O — CID 83238815

IUPAC3-pentan-2-yl-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(C(C)CCC)C1=O
InChIInChI=1S/C14H28N2O/c1-5-8-11(4)16-13(10-7-3)15-12(9-6-2)14(16)17/h11-13,15H,5-10H2,1-4H3
InChIKeyGPHMQYJIRCBJFN-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.90
Rot. Bonds7

About 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one

3-pentan-2-yl-2,5-dipropylimidazolidin-4-one (PubChem CID 83238815) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one.

Molecular Properties

Compound Name3-pentan-2-yl-2,5-dipropylimidazolidin-4-one
PubChem CID83238815
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name3-pentan-2-yl-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(C(C)CCC)C1=O
InChIInChI=1S/C14H28N2O/c1-5-8-11(4)16-13(10-7-3)15-12(9-6-2)14(16)17/h11-13,15H,5-10H2,1-4H3
InChIKeyGPHMQYJIRCBJFN-UHFFFAOYSA-N
XLogP2.90
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one
CID 83238801
2-(2-methylpropyl)-3-octan-2-yl-5-propylimidazolidin-4-one
CID 83248176
3-(1-cyclopropylethyl)-2,5-dipropylimidazolidin-4-one
CID 83243771
3-pentan-2-yl-2-phenyl-5-propylimidazolidin-4-one
CID 83239646
5-butyl-2-methyl-3-pentan-2-ylimidazolidin-4-one
CID 83239016
2-methyl-3-(6-methylheptan-2-yl)-5-propylimidazolidin-4-one
CID 83252812
1-pentan-2-yl-6-propan-2-yl-3-propylpiperazine-2,5-dione
CID 64957236
3-(4-methylhexan-2-yl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83264410
5-butyl-3-(2-methylpentan-3-yl)-2-propylimidazolidin-4-one
CID 83245310
5-butyl-3-(3,3-dimethylbutan-2-yl)-2-propylimidazolidin-4-one
CID 104830708
3-(2-methylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83242304
2-(2-fluorophenyl)-3-pentan-2-yl-5-propylimidazolidin-4-one
CID 83237041

Frequently Asked Questions

What is the IUPAC name of 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one?
The IUPAC name of 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one (CID 83238815) is 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one.
What is the SMILES notation for 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one?
The canonical SMILES for 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one is CCCC1NC(CCC)N(C(C)CCC)C1=O.
What is the InChIKey of 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one?
The InChIKey is GPHMQYJIRCBJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-8-11(4)16-13(10-7-3)15-12(9-6-2)14(16)17/h11-13,15H,5-10H2,1-4H3.
What are the key properties of 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one?
3-pentan-2-yl-2,5-dipropylimidazolidin-4-one has a molecular weight of 240.39 g/mol, XLogP of 2.90, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pentan-2-yl-2,5-dipropylimidazolidin-4-one is sourced from PubChem (CID 83238815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).