[3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite

C10H18FNO — CID 156729614

IUPAC[3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite
SMILESCC1CCN(C2CC(OF)C2)CC1
InChIInChI=1S/C10H18FNO/c1-8-2-4-12(5-3-8)9-6-10(7-9)13-11/h8-10H,2-7H2,1H3
InChIKeyTZWJHLFLSLKGHM-UHFFFAOYSA-N
MW187.26 g/mol
LogP2.15
Rot. Bonds2

About [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite

[3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite (PubChem CID 156729614) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite.

Molecular Properties

Compound Name[3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite
PubChem CID156729614
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name[3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite
SMILESCC1CCN(C2CC(OF)C2)CC1
InChIInChI=1S/C10H18FNO/c1-8-2-4-12(5-3-8)9-6-10(7-9)13-11/h8-10H,2-7H2,1H3
InChIKeyTZWJHLFLSLKGHM-UHFFFAOYSA-N
XLogP2.15
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,4S)-3-fluoro-1-(3-methoxycyclobutyl)-4-methylpiperidine
CID 166077805
3,3-Difluoro-1-(3-methoxycyclobutyl)-4-methylpiperidine
CID 166078022
(3S,4R)-3-fluoro-1-(3-methoxycyclobutyl)-4-propan-2-ylpiperidine
CID 166496531
(3R,4R)-3-fluoro-1-(3-methoxycyclobutyl)-4-propan-2-ylpiperidine
CID 166496578
(3S,4S)-3-fluoro-1-(3-methoxycyclobutyl)-4-methylpiperidine
CID 167217770
3-Fluoro-1-(3-methoxycyclobutyl)piperidine
CID 167217821
4-Fluoro-1-(3-methoxycyclobutyl)piperidine
CID 167217869
(3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine
CID 167549401
1-(3-Fluoropentyl)-4-(3-methylcyclobutyl)oxypiperidine
CID 167565986
(3R,4S)-3-fluoro-1-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]-4-propan-2-ylpiperidine
CID 168081137
(3R,4R)-3-fluoro-4-methyl-1-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]piperidine
CID 169684994
3-Fluoro-1-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]piperidine
CID 169685098

Frequently Asked Questions

What is the IUPAC name of [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite?
The IUPAC name of [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite (CID 156729614) is [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite.
What is the SMILES notation for [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite?
The canonical SMILES for [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite is CC1CCN(C2CC(OF)C2)CC1.
What is the InChIKey of [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite?
The InChIKey is TZWJHLFLSLKGHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c1-8-2-4-12(5-3-8)9-6-10(7-9)13-11/h8-10H,2-7H2,1H3.
What are the key properties of [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite?
[3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite has a molecular weight of 187.26 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methylpiperidin-1-yl)cyclobutyl] hypofluorite is sourced from PubChem (CID 156729614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).