1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol

C11H19N3O — CID 112628258

IUPAC1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol
SMILESCC(O)C1CCN(CCn2ccnc2)C1
InChIInChI=1S/C11H19N3O/c1-10(15)11-2-4-13(8-11)6-7-14-5-3-12-9-14/h3,5,9-11,15H,2,4,6-8H2,1H3
InChIKeyMYHPBQCHVHHCMF-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.59
Rot. Bonds4

About 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol

1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol (PubChem CID 112628258) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol.

Molecular Properties

Compound Name1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol
PubChem CID112628258
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol
SMILESCC(O)C1CCN(CCn2ccnc2)C1
InChIInChI=1S/C11H19N3O/c1-10(15)11-2-4-13(8-11)6-7-14-5-3-12-9-14/h3,5,9-11,15H,2,4,6-8H2,1H3
InChIKeyMYHPBQCHVHHCMF-UHFFFAOYSA-N
XLogP0.59
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(2-imidazol-1-ylethyl)piperidin-3-yl]ethanamine
CID 63848734
(3R)-1-(2-imidazol-1-ylethyl)pyrrolidin-3-amine
CID 94340676
[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]methanamine
CID 61462956
1-[1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]ethanol
CID 112628491
N-[[1-(2-imidazol-1-ylethyl)piperidin-4-yl]methyl]-2-methylpropan-1-amine
CID 63849479
1-[1-(2-imidazol-1-ylethyl)piperidin-4-yl]-2-phenylethanol
CID 45174481
[1-(2-imidazol-1-ylethyl)-4-methylpiperidin-3-yl]methanamine
CID 114961289
(3S)-1-(3-imidazol-1-ylpropyl)pyrrolidin-3-ol
CID 79031633
1-[1-(3-imidazol-1-ylpropyl)piperidin-4-yl]-N-methylethanamine
CID 63853072
1-(2-pyrrolidin-1-ylethyl)imidazole
CID 19964498
3-chloro-1-(3-imidazol-1-ylpropyl)-4-methylpiperidine
CID 102960102
1-(2-imidazol-1-ylethyl)-3-methylpiperidin-4-one
CID 114500368

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol?
The IUPAC name of 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol (CID 112628258) is 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol.
What is the SMILES notation for 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol?
The canonical SMILES for 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol is CC(O)C1CCN(CCn2ccnc2)C1.
What is the InChIKey of 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol?
The InChIKey is MYHPBQCHVHHCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-10(15)11-2-4-13(8-11)6-7-14-5-3-12-9-14/h3,5,9-11,15H,2,4,6-8H2,1H3.
What are the key properties of 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol?
1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol has a molecular weight of 209.29 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]ethanol is sourced from PubChem (CID 112628258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).