5-hydroxy-1-pentylimidazolidin-2-one

C8H16N2O2 — CID 155782465

IUPAC5-hydroxy-1-pentylimidazolidin-2-one
SMILESCCCCCN1C(=O)NCC1O
InChIInChI=1S/C8H16N2O2/c1-2-3-4-5-10-7(11)6-9-8(10)12/h7,11H,2-6H2,1H3,(H,9,12)
InChIKeyRMLRECLKUSHBKP-UHFFFAOYSA-N
MW172.23 g/mol
LogP0.52
Rot. Bonds4

About 5-hydroxy-1-pentylimidazolidin-2-one

5-hydroxy-1-pentylimidazolidin-2-one (PubChem CID 155782465) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 5-hydroxy-1-pentylimidazolidin-2-one.

Molecular Properties

Compound Name5-hydroxy-1-pentylimidazolidin-2-one
PubChem CID155782465
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name5-hydroxy-1-pentylimidazolidin-2-one
SMILESCCCCCN1C(=O)NCC1O
InChIInChI=1S/C8H16N2O2/c1-2-3-4-5-10-7(11)6-9-8(10)12/h7,11H,2-6H2,1H3,(H,9,12)
InChIKeyRMLRECLKUSHBKP-UHFFFAOYSA-N
XLogP0.52
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-pentylimidazolidin-2-one?
The IUPAC name of 5-hydroxy-1-pentylimidazolidin-2-one (CID 155782465) is 5-hydroxy-1-pentylimidazolidin-2-one.
What is the SMILES notation for 5-hydroxy-1-pentylimidazolidin-2-one?
The canonical SMILES for 5-hydroxy-1-pentylimidazolidin-2-one is CCCCCN1C(=O)NCC1O.
What is the InChIKey of 5-hydroxy-1-pentylimidazolidin-2-one?
The InChIKey is RMLRECLKUSHBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-2-3-4-5-10-7(11)6-9-8(10)12/h7,11H,2-6H2,1H3,(H,9,12).
What are the key properties of 5-hydroxy-1-pentylimidazolidin-2-one?
5-hydroxy-1-pentylimidazolidin-2-one has a molecular weight of 172.23 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-pentylimidazolidin-2-one is sourced from PubChem (CID 155782465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).