(3R)-3-(3,5-difluorophenoxy)piperidine

C11H13F2NO — CID 94586724

IUPAC(3R)-3-(3,5-difluorophenoxy)piperidine
SMILESFc1cc(F)cc(O[C@@H]2CCCNC2)c1
InChIInChI=1S/C11H13F2NO/c12-8-4-9(13)6-11(5-8)15-10-2-1-3-14-7-10/h4-6,10,14H,1-3,7H2/t10-/m1/s1
InChIKeyCCVKUMNWACZWDL-SNVBAGLBSA-N
MW213.23 g/mol
LogP2.10
Rot. Bonds2

About (3R)-3-(3,5-difluorophenoxy)piperidine

(3R)-3-(3,5-difluorophenoxy)piperidine (PubChem CID 94586724) has the molecular formula C11H13F2NO and a molecular weight of 213.23 g/mol. Its IUPAC name is (3R)-3-(3,5-difluorophenoxy)piperidine.

Molecular Properties

Compound Name(3R)-3-(3,5-difluorophenoxy)piperidine
PubChem CID94586724
Molecular FormulaC11H13F2NO
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name(3R)-3-(3,5-difluorophenoxy)piperidine
SMILESFc1cc(F)cc(O[C@@H]2CCCNC2)c1
InChIInChI=1S/C11H13F2NO/c12-8-4-9(13)6-11(5-8)15-10-2-1-3-14-7-10/h4-6,10,14H,1-3,7H2/t10-/m1/s1
InChIKeyCCVKUMNWACZWDL-SNVBAGLBSA-N
XLogP2.10
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4,5-trimethylphenoxy)piperidine
CID 91468136
3-(3,5-dimethylphenoxy)azepane
CID 82019169
2-fluoro-4-piperidin-3-yloxyaniline
CID 89089134
(3R)-3-phenoxypiperidine
CID 42553363
(3S)-3-(2,3,4,5,6-pentafluorophenoxy)piperidine
CID 66246609
(3S)-3-(4-fluorophenoxy)pyrrolidine
CID 26192125
2-fluoro-4-[(3R)-piperidin-3-yl]oxybenzonitrile
CID 86333460
(3R)-3-(3,4-dimethylphenoxy)piperidine
CID 26191417
3-(2-bromo-4-fluorophenoxy)piperidine
CID 24902400
3-(2-fluoro-4-methoxyphenoxy)piperidine
CID 84689805
5-fluoro-2-[(3S)-piperidin-3-yl]oxypyridine
CID 66247992
3,5-difluoro-4-piperidin-3-yloxybenzonitrile
CID 81286798

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(3,5-difluorophenoxy)piperidine?
The IUPAC name of (3R)-3-(3,5-difluorophenoxy)piperidine (CID 94586724) is (3R)-3-(3,5-difluorophenoxy)piperidine.
What is the SMILES notation for (3R)-3-(3,5-difluorophenoxy)piperidine?
The canonical SMILES for (3R)-3-(3,5-difluorophenoxy)piperidine is Fc1cc(F)cc(O[C@@H]2CCCNC2)c1.
What is the InChIKey of (3R)-3-(3,5-difluorophenoxy)piperidine?
The InChIKey is CCVKUMNWACZWDL-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13F2NO/c12-8-4-9(13)6-11(5-8)15-10-2-1-3-14-7-10/h4-6,10,14H,1-3,7H2/t10-/m1/s1.
What are the key properties of (3R)-3-(3,5-difluorophenoxy)piperidine?
(3R)-3-(3,5-difluorophenoxy)piperidine has a molecular weight of 213.23 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(3,5-difluorophenoxy)piperidine is sourced from PubChem (CID 94586724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).