1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one

C15H30N2O2 — CID 22381346

IUPAC1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one
SMILESCCCCC(CC)C(O)C(CC)CN1CCNC1=O
InChIInChI=1S/C15H30N2O2/c1-4-7-8-12(5-2)14(18)13(6-3)11-17-10-9-16-15(17)19/h12-14,18H,4-11H2,1-3H3,(H,16,19)
InChIKeyCZAVRVLRMKWNJC-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.62
Rot. Bonds9

About 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one

1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one (PubChem CID 22381346) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one
PubChem CID22381346
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one
SMILESCCCCC(CC)C(O)C(CC)CN1CCNC1=O
InChIInChI=1S/C15H30N2O2/c1-4-7-8-12(5-2)14(18)13(6-3)11-17-10-9-16-15(17)19/h12-14,18H,4-11H2,1-3H3,(H,16,19)
InChIKeyCZAVRVLRMKWNJC-UHFFFAOYSA-N
XLogP2.62
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one?
The IUPAC name of 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one (CID 22381346) is 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one.
What is the SMILES notation for 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one?
The canonical SMILES for 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one is CCCCC(CC)C(O)C(CC)CN1CCNC1=O.
What is the InChIKey of 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one?
The InChIKey is CZAVRVLRMKWNJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-4-7-8-12(5-2)14(18)13(6-3)11-17-10-9-16-15(17)19/h12-14,18H,4-11H2,1-3H3,(H,16,19).
What are the key properties of 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one?
1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one has a molecular weight of 270.42 g/mol, XLogP of 2.62, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-diethyl-3-hydroxyoctyl)imidazolidin-2-one is sourced from PubChem (CID 22381346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).