2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol

C9H17N3O — CID 82559905

IUPAC2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol
SMILESCN(C)CCc1nccn1CCO
InChIInChI=1S/C9H17N3O/c1-11(2)5-3-9-10-4-6-12(9)7-8-13/h4,6,13H,3,5,7-8H2,1-2H3
InChIKeyQZSJLRXPNCEKMR-UHFFFAOYSA-N
MW183.25 g/mol
LogP-0.02
Rot. Bonds5

About 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol

2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol (PubChem CID 82559905) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol
PubChem CID82559905
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol
SMILESCN(C)CCc1nccn1CCO
InChIInChI=1S/C9H17N3O/c1-11(2)5-3-9-10-4-6-12(9)7-8-13/h4,6,13H,3,5,7-8H2,1-2H3
InChIKeyQZSJLRXPNCEKMR-UHFFFAOYSA-N
XLogP-0.02
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]propan-1-amine
CID 82557807
2-[2-[2-(4-methoxyphenyl)ethyl]imidazol-1-yl]ethanol
CID 82560023
4-[1-(2-ethoxyethyl)imidazol-2-yl]-N,N-dimethylbutan-1-amine
CID 57144402
2-(2-iodoimidazol-1-yl)ethanol
CID 126999372
4-(dimethylamino)-1-(1-propylimidazol-2-yl)butan-2-one
CID 115345722
3-(1-butylimidazol-2-yl)-N,N-bis[3-(1-butylimidazol-2-yl)propyl]propan-1-amine
CID 140833527
2-[[2-[2-(dimethylamino)ethyl]imidazol-1-yl]methyl]benzenecarboximidamide
CID 82557818
2-[2-[(2-bromoethylamino)methyl]imidazol-1-yl]ethanol
CID 142780018
3-(1-ethylimidazol-2-yl)-N-[3-(1-ethylimidazol-2-yl)propyl]-N-methylpropan-1-amine
CID 140833519
(2-butylimidazol-1-yl)methanol
CID 22012500
[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol
CID 62223688
1-[1-(2-hydroxyethyl)imidazol-2-yl]ethanone
CID 91602067

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol?
The IUPAC name of 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol (CID 82559905) is 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol.
What is the SMILES notation for 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol?
The canonical SMILES for 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol is CN(C)CCc1nccn1CCO.
What is the InChIKey of 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol?
The InChIKey is QZSJLRXPNCEKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-11(2)5-3-9-10-4-6-12(9)7-8-13/h4,6,13H,3,5,7-8H2,1-2H3.
What are the key properties of 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol?
2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol has a molecular weight of 183.25 g/mol, XLogP of -0.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(dimethylamino)ethyl]imidazol-1-yl]ethanol is sourced from PubChem (CID 82559905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).