1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine

C14H27NO2 — CID 168985547

IUPAC1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine
SMILESC=C(OCCOCCC)C1(C)CCN(C)CC1
InChIInChI=1S/C14H27NO2/c1-5-10-16-11-12-17-13(2)14(3)6-8-15(4)9-7-14/h2,5-12H2,1,3-4H3
InChIKeyUNFORAVSWPRPAI-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.68
Rot. Bonds7

About 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine

1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine (PubChem CID 168985547) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine.

Molecular Properties

Compound Name1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine
PubChem CID168985547
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine
SMILESC=C(OCCOCCC)C1(C)CCN(C)CC1
InChIInChI=1S/C14H27NO2/c1-5-10-16-11-12-17-13(2)14(3)6-8-15(4)9-7-14/h2,5-12H2,1,3-4H3
InChIKeyUNFORAVSWPRPAI-UHFFFAOYSA-N
XLogP2.68
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(3,3-Dimethylpent-1-en-2-yloxy)ethyl]piperidine
CID 164068401
1-Methyl-4-(1-propan-2-yloxyethenyl)-4-prop-2-enylpiperidine
CID 163236418

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine?
The IUPAC name of 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine (CID 168985547) is 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine.
What is the SMILES notation for 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine?
The canonical SMILES for 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine is C=C(OCCOCCC)C1(C)CCN(C)CC1.
What is the InChIKey of 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine?
The InChIKey is UNFORAVSWPRPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-5-10-16-11-12-17-13(2)14(3)6-8-15(4)9-7-14/h2,5-12H2,1,3-4H3.
What are the key properties of 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine?
1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine has a molecular weight of 241.37 g/mol, XLogP of 2.68, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-4-[1-(2-propoxyethoxy)ethenyl]piperidine is sourced from PubChem (CID 168985547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).