2-[(2,3-dimethylphenoxy)methyl]piperidine

C14H21NO — CID 43823216

IUPAC2-[(2,3-dimethylphenoxy)methyl]piperidine
SMILESCc1cccc(OCC2CCCCN2)c1C
InChIInChI=1S/C14H21NO/c1-11-6-5-8-14(12(11)2)16-10-13-7-3-4-9-15-13/h5-6,8,13,15H,3-4,7,9-10H2,1-2H3
InChIKeyOOGRWXPWOGJIFT-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.82
Rot. Bonds3

About 2-[(2,3-dimethylphenoxy)methyl]piperidine

2-[(2,3-dimethylphenoxy)methyl]piperidine (PubChem CID 43823216) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-[(2,3-dimethylphenoxy)methyl]piperidine.

Molecular Properties

Compound Name2-[(2,3-dimethylphenoxy)methyl]piperidine
PubChem CID43823216
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-[(2,3-dimethylphenoxy)methyl]piperidine
SMILESCc1cccc(OCC2CCCCN2)c1C
InChIInChI=1S/C14H21NO/c1-11-6-5-8-14(12(11)2)16-10-13-7-3-4-9-15-13/h5-6,8,13,15H,3-4,7,9-10H2,1-2H3
InChIKeyOOGRWXPWOGJIFT-UHFFFAOYSA-N
XLogP2.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydro-1H-inden-4-yloxymethyl)piperidine;hydrochloride
CID 164888275
(2R)-2-[(2,3,5-trimethylphenoxy)methyl]pyrrolidine
CID 102820009
4-(azepan-2-ylmethoxy)-3-methylphenol
CID 84698847
2-(1-benzofuran-7-yloxymethyl)piperidine
CID 84694616
[2-[[(2R)-pyrrolidin-2-yl]methoxy]phenyl]methanol
CID 102820156
(2S)-2-[(2-propan-2-ylphenoxy)methyl]pyrrolidine
CID 28750009
(2S)-2-[(2-tert-butyl-6-methylphenoxy)methyl]pyrrolidine
CID 28750060
N-methyl-2-(piperidin-2-ylmethoxy)benzenesulfonamide
CID 62349156
(2S)-2-[(2-phenylphenoxy)methyl]pyrrolidine
CID 28750068
(2S)-2-[(5-bromo-2-methylphenoxy)methyl]pyrrolidine
CID 107284582
(2R)-2-[(3-chloro-2-fluorophenoxy)methyl]pyrrolidine
CID 102820264
2-bromo-6-(piperidin-2-ylmethoxy)benzamide
CID 114887724

Frequently Asked Questions

What is the IUPAC name of 2-[(2,3-dimethylphenoxy)methyl]piperidine?
The IUPAC name of 2-[(2,3-dimethylphenoxy)methyl]piperidine (CID 43823216) is 2-[(2,3-dimethylphenoxy)methyl]piperidine.
What is the SMILES notation for 2-[(2,3-dimethylphenoxy)methyl]piperidine?
The canonical SMILES for 2-[(2,3-dimethylphenoxy)methyl]piperidine is Cc1cccc(OCC2CCCCN2)c1C.
What is the InChIKey of 2-[(2,3-dimethylphenoxy)methyl]piperidine?
The InChIKey is OOGRWXPWOGJIFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-6-5-8-14(12(11)2)16-10-13-7-3-4-9-15-13/h5-6,8,13,15H,3-4,7,9-10H2,1-2H3.
What are the key properties of 2-[(2,3-dimethylphenoxy)methyl]piperidine?
2-[(2,3-dimethylphenoxy)methyl]piperidine has a molecular weight of 219.33 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,3-dimethylphenoxy)methyl]piperidine is sourced from PubChem (CID 43823216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).