1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine

C14H25N3O — CID 86793081

IUPAC1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine
SMILESCCOC(C)c1nccn1CCN1CCCCC1
InChIInChI=1S/C14H25N3O/c1-3-18-13(2)14-15-7-10-17(14)12-11-16-8-5-4-6-9-16/h7,10,13H,3-6,8-9,11-12H2,1-2H3
InChIKeyGMSRSOXVCGCWMG-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.47
Rot. Bonds6

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

1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine (PubChem CID 86793081) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine.

Molecular Properties

Compound Name1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine
PubChem CID86793081
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine
SMILESCCOC(C)c1nccn1CCN1CCCCC1
InChIInChI=1S/C14H25N3O/c1-3-18-13(2)14-15-7-10-17(14)12-11-16-8-5-4-6-9-16/h7,10,13H,3-6,8-9,11-12H2,1-2H3
InChIKeyGMSRSOXVCGCWMG-UHFFFAOYSA-N
XLogP2.47
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5H,6H,8H-imidazo[2,1-c][1,4]oxazine
CID 21941433
5H,6H,7H,8H-imidazo[1,2-a]pyridin-8-ol
CID 10374525
2-(methoxymethyl)-1-methyl-1H-imidazole
CID 19848332
1-(1-methyl-1H-imidazol-2-yl)ethan-1-ol
CID 21784237
1-(1-ethyl-1H-imidazol-2-yl)ethan-1-ol
CID 23564054
(1S)-1-(1-methyl-1H-imidazol-2-yl)ethan-1-ol
CID 81681206
1-[4-[(1-Ethylimidazol-2-yl)methyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 53564615
2-Methyl-4-[1-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]piperidin-4-yl]morpholine
CID 53606404
4-{2-[4-(1-methyl-1H-imidazol-2-yl)-1-piperidinyl]ethyl}morpholine
CID 70756829
N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine
CID 75367326
(1-methylimidazol-2-yl)methyl (2S,6R)-2,6-dimethylmorpholine-4-carboxylate
CID 172436919
4-[2-(2-Methylimidazol-1-yl)ethyl]morpholine
CID 56798444

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine?
The IUPAC name of 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine (CID 86793081) is 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine.
What is the SMILES notation for 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine?
The canonical SMILES for 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine is CCOC(C)c1nccn1CCN1CCCCC1.
What is the InChIKey of 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine?
The InChIKey is GMSRSOXVCGCWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-3-18-13(2)14-15-7-10-17(14)12-11-16-8-5-4-6-9-16/h7,10,13H,3-6,8-9,11-12H2,1-2H3.
What are the key properties of 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine?
1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine has a molecular weight of 251.37 g/mol, XLogP of 2.47, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(1-ethoxyethyl)imidazol-1-yl]ethyl]piperidine is sourced from PubChem (CID 86793081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).