ethanol;2-undecyl-2,3-dihydro-1H-imidazole

C16H34N2O — CID 174912710

IUPACethanol;2-undecyl-2,3-dihydro-1H-imidazole
SMILESCCCCCCCCCCCC1NC=CN1.CCO
InChIInChI=1S/C14H28N2.C2H6O/c1-2-3-4-5-6-7-8-9-10-11-14-15-12-13-16-14;1-2-3/h12-16H,2-11H2,1H3;3H,2H2,1H3
InChIKeyFMUHPLIGOITLAF-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.90
Rot. Bonds10

About ethanol;2-undecyl-2,3-dihydro-1H-imidazole

ethanol;2-undecyl-2,3-dihydro-1H-imidazole (PubChem CID 174912710) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is ethanol;2-undecyl-2,3-dihydro-1H-imidazole.

Molecular Properties

Compound Nameethanol;2-undecyl-2,3-dihydro-1H-imidazole
PubChem CID174912710
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Nameethanol;2-undecyl-2,3-dihydro-1H-imidazole
SMILESCCCCCCCCCCCC1NC=CN1.CCO
InChIInChI=1S/C14H28N2.C2H6O/c1-2-3-4-5-6-7-8-9-10-11-14-15-12-13-16-14;1-2-3/h12-16H,2-11H2,1H3;3H,2H2,1H3
InChIKeyFMUHPLIGOITLAF-UHFFFAOYSA-N
XLogP3.90
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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 ethanol;2-undecyl-2,3-dihydro-1H-imidazole?
The IUPAC name of ethanol;2-undecyl-2,3-dihydro-1H-imidazole (CID 174912710) is ethanol;2-undecyl-2,3-dihydro-1H-imidazole.
What is the SMILES notation for ethanol;2-undecyl-2,3-dihydro-1H-imidazole?
The canonical SMILES for ethanol;2-undecyl-2,3-dihydro-1H-imidazole is CCCCCCCCCCCC1NC=CN1.CCO.
What is the InChIKey of ethanol;2-undecyl-2,3-dihydro-1H-imidazole?
The InChIKey is FMUHPLIGOITLAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2.C2H6O/c1-2-3-4-5-6-7-8-9-10-11-14-15-12-13-16-14;1-2-3/h12-16H,2-11H2,1H3;3H,2H2,1H3.
What are the key properties of ethanol;2-undecyl-2,3-dihydro-1H-imidazole?
ethanol;2-undecyl-2,3-dihydro-1H-imidazole has a molecular weight of 270.46 g/mol, XLogP of 3.90, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;2-undecyl-2,3-dihydro-1H-imidazole is sourced from PubChem (CID 174912710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).