(2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine

C14H19F2NO — CID 86321767

IUPAC(2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine
SMILESFc1cccc(F)c1COCC[C@H]1CCCCN1
InChIInChI=1S/C14H19F2NO/c15-13-5-3-6-14(16)12(13)10-18-9-7-11-4-1-2-8-17-11/h3,5-6,11,17H,1-2,4,7-10H2/t11-/m1/s1
InChIKeySGEAHNGZLNCLCM-LLVKDONJSA-N
MW255.31 g/mol
LogP3.01
Rot. Bonds5

About (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine

(2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine (PubChem CID 86321767) has the molecular formula C14H19F2NO and a molecular weight of 255.31 g/mol. Its IUPAC name is (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine.

Molecular Properties

Compound Name(2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine
PubChem CID86321767
Molecular FormulaC14H19F2NO
Molecular Weight255.31 g/mol
Exact Mass255.14
IUPAC Name(2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine
SMILESFc1cccc(F)c1COCC[C@H]1CCCCN1
InChIInChI=1S/C14H19F2NO/c15-13-5-3-6-14(16)12(13)10-18-9-7-11-4-1-2-8-17-11/h3,5-6,11,17H,1-2,4,7-10H2/t11-/m1/s1
InChIKeySGEAHNGZLNCLCM-LLVKDONJSA-N
XLogP3.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.31
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[(2-chlorophenyl)methoxy]ethyl]piperidine;hydrochloride
CID 56829905
2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine
CID 65317213
2-[2-[(4-iodophenyl)methoxy]ethyl]piperidine;hydrochloride
CID 56830523
2-[2-[(4-methoxyphenyl)methoxy]ethyl]piperidine
CID 56830572
2-[2-[(3-nitrophenyl)methoxy]ethyl]piperidine
CID 62342977
2-[2-(4-phenylbutoxy)ethyl]piperidine
CID 114334035
2-[2-[(4-propan-2-ylphenyl)methoxy]ethyl]piperidine;hydrochloride
CID 56829984
methyl 3-(2-piperidin-2-ylethoxymethyl)benzoate
CID 82353189
2-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]piperidine
CID 82354069
3-methyl-5-(2-piperidin-2-ylethoxymethyl)pyridine
CID 102877250
2-(2,6-difluorophenyl)-N-(2-pyrrolidin-2-ylethyl)acetamide
CID 114793681
2-[2-[2-(3-methoxyphenoxy)ethoxy]ethyl]piperidine
CID 82354047

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine?
The IUPAC name of (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine (CID 86321767) is (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine.
What is the SMILES notation for (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine?
The canonical SMILES for (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine is Fc1cccc(F)c1COCC[C@H]1CCCCN1.
What is the InChIKey of (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine?
The InChIKey is SGEAHNGZLNCLCM-LLVKDONJSA-N. The full InChI is InChI=1S/C14H19F2NO/c15-13-5-3-6-14(16)12(13)10-18-9-7-11-4-1-2-8-17-11/h3,5-6,11,17H,1-2,4,7-10H2/t11-/m1/s1.
What are the key properties of (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine?
(2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine has a molecular weight of 255.31 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine is sourced from PubChem (CID 86321767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).