1-[2-(1-iodoethoxy)ethyl]piperidine

C9H18INO — CID 134214005

IUPAC1-[2-(1-iodoethoxy)ethyl]piperidine
SMILESCC(I)OCCN1CCCCC1
InChIInChI=1S/C9H18INO/c1-9(10)12-8-7-11-5-3-2-4-6-11/h9H,2-8H2,1H3
InChIKeyAZUAMCZLVPLULF-UHFFFAOYSA-N
MW283.15 g/mol
LogP2.27
Rot. Bonds4

About 1-[2-(1-iodoethoxy)ethyl]piperidine

1-[2-(1-iodoethoxy)ethyl]piperidine (PubChem CID 134214005) has the molecular formula C9H18INO and a molecular weight of 283.15 g/mol. Its IUPAC name is 1-[2-(1-iodoethoxy)ethyl]piperidine.

Molecular Properties

Compound Name1-[2-(1-iodoethoxy)ethyl]piperidine
PubChem CID134214005
Molecular FormulaC9H18INO
Molecular Weight283.15 g/mol
Exact Mass283.04
IUPAC Name1-[2-(1-iodoethoxy)ethyl]piperidine
SMILESCC(I)OCCN1CCCCC1
InChIInChI=1S/C9H18INO/c1-9(10)12-8-7-11-5-3-2-4-6-11/h9H,2-8H2,1H3
InChIKeyAZUAMCZLVPLULF-UHFFFAOYSA-N
XLogP2.27
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.15
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1-[2-[1-[2-(azepan-1-yl)ethoxy]ethoxy]ethyl]azepane
CID 57016594
1-[2-(3-methylbutan-2-yloxy)ethyl]piperidine
CID 147408138
4-(2-propan-2-yloxyethyl)morpholine;1-(2-propan-2-yloxyethyl)piperidine
CID 158440529
1-(2-methoxyethyl)azocane
CID 47014834
1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethyl]piperidine
CID 59204102
3-methoxy-2-(2-piperidin-1-ylethoxy)propan-1-amine
CID 103228301
2-methyl-N-[2-(2-pyrrolidin-1-ylethoxy)propyl]propan-1-amine
CID 62460018
2-piperidin-1-ylethyl 2-methylbutanoate
CID 20697106
diethyl 2-(2-piperidin-1-ylethoxy)propanedioate
CID 57233413
1-(2-ethoxyethyl)piperidine
CID 22622871
1-(4-propan-2-yloxybutyl)pyrrolidine
CID 20742855
N-methyl-2-(2-pyrrolidin-1-ylethoxy)butan-1-amine
CID 62460019

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-iodoethoxy)ethyl]piperidine?
The IUPAC name of 1-[2-(1-iodoethoxy)ethyl]piperidine (CID 134214005) is 1-[2-(1-iodoethoxy)ethyl]piperidine.
What is the SMILES notation for 1-[2-(1-iodoethoxy)ethyl]piperidine?
The canonical SMILES for 1-[2-(1-iodoethoxy)ethyl]piperidine is CC(I)OCCN1CCCCC1.
What is the InChIKey of 1-[2-(1-iodoethoxy)ethyl]piperidine?
The InChIKey is AZUAMCZLVPLULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18INO/c1-9(10)12-8-7-11-5-3-2-4-6-11/h9H,2-8H2,1H3.
What are the key properties of 1-[2-(1-iodoethoxy)ethyl]piperidine?
1-[2-(1-iodoethoxy)ethyl]piperidine has a molecular weight of 283.15 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-iodoethoxy)ethyl]piperidine is sourced from PubChem (CID 134214005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).