1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine

C10H18FNO — CID 143192773

IUPAC1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine
SMILESC=C(OCCF)N1CCC(C)CC1
InChIInChI=1S/C10H18FNO/c1-9-3-6-12(7-4-9)10(2)13-8-5-11/h9H,2-8H2,1H3
InChIKeyYJQITRSCTXOKDO-UHFFFAOYSA-N
MW187.26 g/mol
LogP2.18
Rot. Bonds4

About 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine

1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine (PubChem CID 143192773) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine.

Molecular Properties

Compound Name1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine
PubChem CID143192773
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine
SMILESC=C(OCCF)N1CCC(C)CC1
InChIInChI=1S/C10H18FNO/c1-9-3-6-12(7-4-9)10(2)13-8-5-11/h9H,2-8H2,1H3
InChIKeyYJQITRSCTXOKDO-UHFFFAOYSA-N
XLogP2.18
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine?
The IUPAC name of 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine (CID 143192773) is 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine.
What is the SMILES notation for 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine?
The canonical SMILES for 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine is C=C(OCCF)N1CCC(C)CC1.
What is the InChIKey of 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine?
The InChIKey is YJQITRSCTXOKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c1-9-3-6-12(7-4-9)10(2)13-8-5-11/h9H,2-8H2,1H3.
What are the key properties of 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine?
1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine has a molecular weight of 187.26 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluoroethoxy)ethenyl]-4-methylpiperidine is sourced from PubChem (CID 143192773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).