(3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine

C10H18FNO — CID 167549401

IUPAC(3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine
SMILESCOC1CC(N2CCC[C@@H](F)C2)C1
InChIInChI=1S/C10H18FNO/c1-13-10-5-9(6-10)12-4-2-3-8(11)7-12/h8-10H,2-7H2,1H3/t8-,9?,10?/m1/s1
InChIKeyHVSMCMFMJNTYNG-XNWIYYODSA-N
MW187.26 g/mol
LogP1.60
Rot. Bonds2

About (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine

(3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine (PubChem CID 167549401) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine.

Molecular Properties

Compound Name(3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine
PubChem CID167549401
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name(3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine
SMILESCOC1CC(N2CCC[C@@H](F)C2)C1
InChIInChI=1S/C10H18FNO/c1-13-10-5-9(6-10)12-4-2-3-8(11)7-12/h8-10H,2-7H2,1H3/t8-,9?,10?/m1/s1
InChIKeyHVSMCMFMJNTYNG-XNWIYYODSA-N
XLogP1.60
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 ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine?
The IUPAC name of (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine (CID 167549401) is (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine.
What is the SMILES notation for (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine?
The canonical SMILES for (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine is COC1CC(N2CCC[C@@H](F)C2)C1.
What is the InChIKey of (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine?
The InChIKey is HVSMCMFMJNTYNG-XNWIYYODSA-N. The full InChI is InChI=1S/C10H18FNO/c1-13-10-5-9(6-10)12-4-2-3-8(11)7-12/h8-10H,2-7H2,1H3/t8-,9?,10?/m1/s1.
What are the key properties of (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine?
(3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine has a molecular weight of 187.26 g/mol, XLogP of 1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-fluoro-1-(3-methoxycyclobutyl)piperidine is sourced from PubChem (CID 167549401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).