3-[2-(1H-imidazol-2-yl)ethyl]piperidine

C10H17N3 — CID 84732247

IUPAC3-[2-(1H-imidazol-2-yl)ethyl]piperidine
SMILESc1c[nH]c(CCC2CCCNC2)n1
InChIInChI=1S/C10H17N3/c1-2-9(8-11-5-1)3-4-10-12-6-7-13-10/h6-7,9,11H,1-5,8H2,(H,12,13)
InChIKeyBOXHUYXFQSHYJS-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.34
Rot. Bonds3

About 3-[2-(1H-imidazol-2-yl)ethyl]piperidine

3-[2-(1H-imidazol-2-yl)ethyl]piperidine (PubChem CID 84732247) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 3-[2-(1H-imidazol-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name3-[2-(1H-imidazol-2-yl)ethyl]piperidine
PubChem CID84732247
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name3-[2-(1H-imidazol-2-yl)ethyl]piperidine
SMILESc1c[nH]c(CCC2CCCNC2)n1
InChIInChI=1S/C10H17N3/c1-2-9(8-11-5-1)3-4-10-12-6-7-13-10/h6-7,9,11H,1-5,8H2,(H,12,13)
InChIKeyBOXHUYXFQSHYJS-UHFFFAOYSA-N
XLogP1.34
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride
CID 167995844
(3S)-1-benzyl-3-(1H-imidazol-2-ylmethyl)piperidine;(3S)-3-(1H-imidazol-2-ylmethyl)piperidine
CID 158336197
N-(2-piperidin-3-ylethyl)pyrimidin-2-amine
CID 63629890
6-(2-piperidin-3-ylethyl)-1H-benzimidazole
CID 116925639
3-(1H-imidazol-2-yl)piperidine
CID 13281195
2-(1H-imidazol-2-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106639435
4-(2-piperidin-3-ylethyl)benzenethiol
CID 142937615
3-[2-(4-fluorophenyl)ethyl]piperidine;hydrochloride
CID 126844820
3-[2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]piperidine
CID 62695306
3-(2-piperidin-3-ylethoxy)pyridazine
CID 62483890
2-[3-(cyclohexylmethyl)-3-methylpentyl]-1H-imidazole
CID 70555412
N-[2-(1H-imidazol-2-yl)ethyl]-4-(pyrrolidin-3-ylmethyl)benzamide;dihydrochloride
CID 171325623

Frequently Asked Questions

What is the IUPAC name of 3-[2-(1H-imidazol-2-yl)ethyl]piperidine?
The IUPAC name of 3-[2-(1H-imidazol-2-yl)ethyl]piperidine (CID 84732247) is 3-[2-(1H-imidazol-2-yl)ethyl]piperidine.
What is the SMILES notation for 3-[2-(1H-imidazol-2-yl)ethyl]piperidine?
The canonical SMILES for 3-[2-(1H-imidazol-2-yl)ethyl]piperidine is c1c[nH]c(CCC2CCCNC2)n1.
What is the InChIKey of 3-[2-(1H-imidazol-2-yl)ethyl]piperidine?
The InChIKey is BOXHUYXFQSHYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-2-9(8-11-5-1)3-4-10-12-6-7-13-10/h6-7,9,11H,1-5,8H2,(H,12,13).
What are the key properties of 3-[2-(1H-imidazol-2-yl)ethyl]piperidine?
3-[2-(1H-imidazol-2-yl)ethyl]piperidine has a molecular weight of 179.27 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1H-imidazol-2-yl)ethyl]piperidine is sourced from PubChem (CID 84732247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).