2-(3-propyl-2H-imidazol-1-yl)ethanol

C8H16N2O — CID 68799972

IUPAC2-(3-propyl-2H-imidazol-1-yl)ethanol
SMILESCCCN1C=CN(CCO)C1
InChIInChI=1S/C8H16N2O/c1-2-3-9-4-5-10(8-9)6-7-11/h4-5,11H,2-3,6-8H2,1H3
InChIKeyPMZIRFIHXVJFBT-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.44
Rot. Bonds4

About 2-(3-propyl-2H-imidazol-1-yl)ethanol

2-(3-propyl-2H-imidazol-1-yl)ethanol (PubChem CID 68799972) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-(3-propyl-2H-imidazol-1-yl)ethanol.

Molecular Properties

Compound Name2-(3-propyl-2H-imidazol-1-yl)ethanol
PubChem CID68799972
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-(3-propyl-2H-imidazol-1-yl)ethanol
SMILESCCCN1C=CN(CCO)C1
InChIInChI=1S/C8H16N2O/c1-2-3-9-4-5-10(8-9)6-7-11/h4-5,11H,2-3,6-8H2,1H3
InChIKeyPMZIRFIHXVJFBT-UHFFFAOYSA-N
XLogP0.44
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Hydroxyethyl-1-vinylimidazole
CID 57070894
1-(2-Hydroxyethyl)-3-methylimidazole
CID 57351561
Hydroxy 1-butyl-3 methyl imidazole
CID 68259944
1-(2-Hydroxyethyl)-3-methylimidazole-2-selone
CID 102443916
2-(3-butyl-2H-imidazol-1-yl)ethanol
CID 52911375
3-(3-methyl-2H-imidazol-1-yl)propan-1-ol
CID 57349221
1-Butyl-3-(2-hydroxyethyl)-2,3-dihydro-1H-imidazol-1-ium chloride
CID 57350019
2-[3-(2-hydroxyethyl)-2H-imidazol-1-yl]ethanol
CID 57832174
2-[3-[[3-(2-hydroxyethyl)-2H-imidazol-1-yl]methyl]-2H-imidazol-1-yl]ethanol
CID 58221260
1-(2,3-dimethyl-2H-imidazol-1-yl)butan-2-ol
CID 58841196
2-(2,3-dimethyl-2H-imidazol-1-yl)ethanol
CID 66763798
1-butyl-3-(2-methoxyethyl)-2H-imidazole
CID 66835312

Frequently Asked Questions

What is the IUPAC name of 2-(3-propyl-2H-imidazol-1-yl)ethanol?
The IUPAC name of 2-(3-propyl-2H-imidazol-1-yl)ethanol (CID 68799972) is 2-(3-propyl-2H-imidazol-1-yl)ethanol.
What is the SMILES notation for 2-(3-propyl-2H-imidazol-1-yl)ethanol?
The canonical SMILES for 2-(3-propyl-2H-imidazol-1-yl)ethanol is CCCN1C=CN(CCO)C1.
What is the InChIKey of 2-(3-propyl-2H-imidazol-1-yl)ethanol?
The InChIKey is PMZIRFIHXVJFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-2-3-9-4-5-10(8-9)6-7-11/h4-5,11H,2-3,6-8H2,1H3.
What are the key properties of 2-(3-propyl-2H-imidazol-1-yl)ethanol?
2-(3-propyl-2H-imidazol-1-yl)ethanol has a molecular weight of 156.23 g/mol, XLogP of 0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propyl-2H-imidazol-1-yl)ethanol is sourced from PubChem (CID 68799972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).