2-[(1R)-1-phenoxyethyl]pyridine

C13H13NO — CID 15893448

IUPAC2-[(1R)-1-phenoxyethyl]pyridine
SMILESC[C@@H](Oc1ccccc1)c1ccccn1
InChIInChI=1S/C13H13NO/c1-11(13-9-5-6-10-14-13)15-12-7-3-2-4-8-12/h2-11H,1H3/t11-/m1/s1
InChIKeyXSKIDWJKVAYSKY-LLVKDONJSA-N
MW199.25 g/mol
LogP3.22
Rot. Bonds3

About 2-[(1R)-1-phenoxyethyl]pyridine

2-[(1R)-1-phenoxyethyl]pyridine (PubChem CID 15893448) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-[(1R)-1-phenoxyethyl]pyridine.

Molecular Properties

Compound Name2-[(1R)-1-phenoxyethyl]pyridine
PubChem CID15893448
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name2-[(1R)-1-phenoxyethyl]pyridine
SMILESC[C@@H](Oc1ccccc1)c1ccccn1
InChIInChI=1S/C13H13NO/c1-11(13-9-5-6-10-14-13)15-12-7-3-2-4-8-12/h2-11H,1H3/t11-/m1/s1
InChIKeyXSKIDWJKVAYSKY-LLVKDONJSA-N
XLogP3.22
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1-pyridin-2-ylethoxy)benzoyl chloride
CID 86648380
1-[3-(1-pyridin-2-ylethoxy)phenyl]ethanone
CID 82037403
methyl 4-(1-pyridin-2-ylethoxy)benzoate
CID 68727423
methyl 2-[4-(1-pyridin-2-ylethoxy)phenyl]acetate
CID 117095036
phenyl N-[(1S)-1-pyridin-2-ylethyl]carbamate
CID 78980082
[(1S)-1-pyridin-2-ylethyl] methanesulfonate
CID 11790238
3-methoxy-4-(1-pyridin-2-ylethoxy)benzoic acid
CID 117053449
3-(methylamino)-1-phenoxy-1-pyridin-2-ylpropan-2-ol
CID 90425937
ethane;2-methylpropane;2-propan-2-ylpyridine
CID 160963174
2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118
ethane;2-(1-phenylethyl)pyridine
CID 143899083
1-(4-propan-2-yloxyphenyl)-N-(1-pyridin-2-ylethyl)ethanamine
CID 43202622

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-1-phenoxyethyl]pyridine?
The IUPAC name of 2-[(1R)-1-phenoxyethyl]pyridine (CID 15893448) is 2-[(1R)-1-phenoxyethyl]pyridine.
What is the SMILES notation for 2-[(1R)-1-phenoxyethyl]pyridine?
The canonical SMILES for 2-[(1R)-1-phenoxyethyl]pyridine is C[C@@H](Oc1ccccc1)c1ccccn1.
What is the InChIKey of 2-[(1R)-1-phenoxyethyl]pyridine?
The InChIKey is XSKIDWJKVAYSKY-LLVKDONJSA-N. The full InChI is InChI=1S/C13H13NO/c1-11(13-9-5-6-10-14-13)15-12-7-3-2-4-8-12/h2-11H,1H3/t11-/m1/s1.
What are the key properties of 2-[(1R)-1-phenoxyethyl]pyridine?
2-[(1R)-1-phenoxyethyl]pyridine has a molecular weight of 199.25 g/mol, XLogP of 3.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-1-phenoxyethyl]pyridine is sourced from PubChem (CID 15893448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).