1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine

C15H28FNO — CID 167565986

IUPAC1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine
SMILESCCC(F)CCN1CCC(OC2CC(C)C2)CC1
InChIInChI=1S/C15H28FNO/c1-3-13(16)4-7-17-8-5-14(6-9-17)18-15-10-12(2)11-15/h12-15H,3-11H2,1-2H3
InChIKeyKRURZEHEKQWWAD-UHFFFAOYSA-N
MW257.39 g/mol
LogP3.40
Rot. Bonds6

About 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine

1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine (PubChem CID 167565986) has the molecular formula C15H28FNO and a molecular weight of 257.39 g/mol. Its IUPAC name is 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine.

Molecular Properties

Compound Name1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine
PubChem CID167565986
Molecular FormulaC15H28FNO
Molecular Weight257.39 g/mol
Exact Mass257.22
IUPAC Name1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine
SMILESCCC(F)CCN1CCC(OC2CC(C)C2)CC1
InChIInChI=1S/C15H28FNO/c1-3-13(16)4-7-17-8-5-14(6-9-17)18-15-10-12(2)11-15/h12-15H,3-11H2,1-2H3
InChIKeyKRURZEHEKQWWAD-UHFFFAOYSA-N
XLogP3.40
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.39
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine?
The IUPAC name of 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine (CID 167565986) is 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine.
What is the SMILES notation for 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine?
The canonical SMILES for 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine is CCC(F)CCN1CCC(OC2CC(C)C2)CC1.
What is the InChIKey of 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine?
The InChIKey is KRURZEHEKQWWAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28FNO/c1-3-13(16)4-7-17-8-5-14(6-9-17)18-15-10-12(2)11-15/h12-15H,3-11H2,1-2H3.
What are the key properties of 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine?
1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine has a molecular weight of 257.39 g/mol, XLogP of 3.40, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine is sourced from PubChem (CID 167565986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).