4-[(3,5-dimethylphenyl)methoxymethyl]piperidine

C15H23NO — CID 62340390

IUPAC4-[(3,5-dimethylphenyl)methoxymethyl]piperidine
SMILESCc1cc(C)cc(COCC2CCNCC2)c1
InChIInChI=1S/C15H23NO/c1-12-7-13(2)9-15(8-12)11-17-10-14-3-5-16-6-4-14/h7-9,14,16H,3-6,10-11H2,1-2H3
InChIKeyOMHSPAIGTVQIIG-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.82
Rot. Bonds4

About 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine

4-[(3,5-dimethylphenyl)methoxymethyl]piperidine (PubChem CID 62340390) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine.

Molecular Properties

Compound Name4-[(3,5-dimethylphenyl)methoxymethyl]piperidine
PubChem CID62340390
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name4-[(3,5-dimethylphenyl)methoxymethyl]piperidine
SMILESCc1cc(C)cc(COCC2CCNCC2)c1
InChIInChI=1S/C15H23NO/c1-12-7-13(2)9-15(8-12)11-17-10-14-3-5-16-6-4-14/h7-9,14,16H,3-6,10-11H2,1-2H3
InChIKeyOMHSPAIGTVQIIG-UHFFFAOYSA-N
XLogP2.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine?
The IUPAC name of 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine (CID 62340390) is 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine.
What is the SMILES notation for 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine?
The canonical SMILES for 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine is Cc1cc(C)cc(COCC2CCNCC2)c1.
What is the InChIKey of 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine?
The InChIKey is OMHSPAIGTVQIIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-7-13(2)9-15(8-12)11-17-10-14-3-5-16-6-4-14/h7-9,14,16H,3-6,10-11H2,1-2H3.
What are the key properties of 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine?
4-[(3,5-dimethylphenyl)methoxymethyl]piperidine has a molecular weight of 233.35 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,5-dimethylphenyl)methoxymethyl]piperidine is sourced from PubChem (CID 62340390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).