4-[(4-benzylphenoxy)methyl]piperidine

C19H23NO — CID 23722975

IUPAC4-[(4-benzylphenoxy)methyl]piperidine
SMILESc1ccc(Cc2ccc(OCC3CCNCC3)cc2)cc1
InChIInChI=1S/C19H23NO/c1-2-4-16(5-3-1)14-17-6-8-19(9-7-17)21-15-18-10-12-20-13-11-18/h1-9,18,20H,10-15H2
InChIKeyPZCHPXMRKKAYBS-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.66
Rot. Bonds5

About 4-[(4-benzylphenoxy)methyl]piperidine

4-[(4-benzylphenoxy)methyl]piperidine (PubChem CID 23722975) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-[(4-benzylphenoxy)methyl]piperidine.

Molecular Properties

Compound Name4-[(4-benzylphenoxy)methyl]piperidine
PubChem CID23722975
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name4-[(4-benzylphenoxy)methyl]piperidine
SMILESc1ccc(Cc2ccc(OCC3CCNCC3)cc2)cc1
InChIInChI=1S/C19H23NO/c1-2-4-16(5-3-1)14-17-6-8-19(9-7-17)21-15-18-10-12-20-13-11-18/h1-9,18,20H,10-15H2
InChIKeyPZCHPXMRKKAYBS-UHFFFAOYSA-N
XLogP3.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(piperidin-4-ylmethoxy)phenyl]ethanol
CID 113242079
(3R)-3-(phenoxymethyl)pyrrolidine
CID 26192487
4-(piperidin-4-ylmethoxy)benzonitrile
CID 10560682
4-(piperidin-4-ylmethoxy)benzaldehyde
CID 154636749
4-[(4-methoxyphenoxy)methyl]piperidine;hydrochloride
CID 23724366
4-[(2-phenylmethoxyphenoxy)methyl]piperidine;hydrochloride
CID 164512463
2-phenyl-5-(piperidin-4-ylmethoxy)pyridine
CID 127025530
cyclopropylmethoxybenzene
CID 12712156
4-[(4-tert-butylphenoxy)methyl]piperidine;hydrochloride
CID 46735634
2-[(4-benzylphenoxy)methyl]morpholine
CID 64533663
3-[2-(4-benzylphenoxy)ethyl]azetidine
CID 107391708
N-[2-(4-benzylphenoxy)ethyl]-2-pyrrolidin-3-ylacetamide
CID 67648354

Frequently Asked Questions

What is the IUPAC name of 4-[(4-benzylphenoxy)methyl]piperidine?
The IUPAC name of 4-[(4-benzylphenoxy)methyl]piperidine (CID 23722975) is 4-[(4-benzylphenoxy)methyl]piperidine.
What is the SMILES notation for 4-[(4-benzylphenoxy)methyl]piperidine?
The canonical SMILES for 4-[(4-benzylphenoxy)methyl]piperidine is c1ccc(Cc2ccc(OCC3CCNCC3)cc2)cc1.
What is the InChIKey of 4-[(4-benzylphenoxy)methyl]piperidine?
The InChIKey is PZCHPXMRKKAYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-4-16(5-3-1)14-17-6-8-19(9-7-17)21-15-18-10-12-20-13-11-18/h1-9,18,20H,10-15H2.
What are the key properties of 4-[(4-benzylphenoxy)methyl]piperidine?
4-[(4-benzylphenoxy)methyl]piperidine has a molecular weight of 281.40 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-benzylphenoxy)methyl]piperidine is sourced from PubChem (CID 23722975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).