2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol

C13H23N3O — CID 62020294

IUPAC2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol
SMILESCc1nccn1CCN1CCCCC1CCO
InChIInChI=1S/C13H23N3O/c1-12-14-6-8-15(12)9-10-16-7-3-2-4-13(16)5-11-17/h6,8,13,17H,2-5,7,9-11H2,1H3
InChIKeyWTPIISHJMFSMIF-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.43
Rot. Bonds5

About 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol

2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol (PubChem CID 62020294) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol
PubChem CID62020294
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol
SMILESCc1nccn1CCN1CCCCC1CCO
InChIInChI=1S/C13H23N3O/c1-12-14-6-8-15(12)9-10-16-7-3-2-4-13(16)5-11-17/h6,8,13,17H,2-5,7,9-11H2,1H3
InChIKeyWTPIISHJMFSMIF-UHFFFAOYSA-N
XLogP1.43
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[2-(3-chloropropyl)pyrrolidin-1-yl]ethyl]-2-methylimidazole
CID 63388388
1-[2-[2-(3-bromopropyl)pyrrolidin-1-yl]ethyl]-2-methylimidazole
CID 80691757
1-[2-[2-(bromomethyl)pyrrolidin-1-yl]ethyl]-2-methylimidazole
CID 80669869
2-[(2-methylimidazol-1-yl)methyl]-1-propylpiperidine
CID 167299183
methyl 1-[2-(2-methylimidazol-1-yl)ethyl]piperidine-2-carboxylate
CID 113330911
N-methyl-1-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanamine
CID 63854336
2-[(2R)-2-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]-N-(1-methylpyrazol-3-yl)acetamide
CID 124842082
(2R)-1-[(1-ethylpyrazol-3-yl)methyl]-2-[2-(2-methylimidazol-1-yl)ethyl]piperidine
CID 124754791
5-[[2-[2-(2-methylimidazol-1-yl)ethyl]piperidin-1-yl]methyl]-1,2,4-oxadiazole-3-carboxamide
CID 70712419
methyl 1-[2-(2-methylimidazol-1-yl)ethyl]pyrrolidine-2-carboxylate
CID 62028229
2-[2-(2-methylimidazol-1-yl)ethyl]-1-[(1-propan-2-ylpyrazol-4-yl)methyl]piperidine
CID 131896236
2-[(2R)-1-methyl-4-[3-(2-methylimidazol-1-yl)propyl]piperazin-2-yl]ethanol
CID 124755980

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol (CID 62020294) is 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol is Cc1nccn1CCN1CCCCC1CCO.
What is the InChIKey of 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol?
The InChIKey is WTPIISHJMFSMIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-12-14-6-8-15(12)9-10-16-7-3-2-4-13(16)5-11-17/h6,8,13,17H,2-5,7,9-11H2,1H3.
What are the key properties of 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol?
2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol has a molecular weight of 237.35 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 62020294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).