4-(2,3-dimethylphenoxy)piperidine

C13H19NO — CID 24694567

IUPAC4-(2,3-dimethylphenoxy)piperidine
SMILESCc1cccc(OC2CCNCC2)c1C
InChIInChI=1S/C13H19NO/c1-10-4-3-5-13(11(10)2)15-12-6-8-14-9-7-12/h3-5,12,14H,6-9H2,1-2H3
InChIKeySWOAHKOFKRMKBP-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.43
Rot. Bonds2

About 4-(2,3-dimethylphenoxy)piperidine

4-(2,3-dimethylphenoxy)piperidine (PubChem CID 24694567) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 4-(2,3-dimethylphenoxy)piperidine.

Molecular Properties

Compound Name4-(2,3-dimethylphenoxy)piperidine
PubChem CID24694567
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name4-(2,3-dimethylphenoxy)piperidine
SMILESCc1cccc(OC2CCNCC2)c1C
InChIInChI=1S/C13H19NO/c1-10-4-3-5-13(11(10)2)15-12-6-8-14-9-7-12/h3-5,12,14H,6-9H2,1-2H3
InChIKeySWOAHKOFKRMKBP-UHFFFAOYSA-N
XLogP2.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2,3-dimethylphenoxy)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylphenoxy)piperidine?
The IUPAC name of 4-(2,3-dimethylphenoxy)piperidine (CID 24694567) is 4-(2,3-dimethylphenoxy)piperidine.
What is the SMILES notation for 4-(2,3-dimethylphenoxy)piperidine?
The canonical SMILES for 4-(2,3-dimethylphenoxy)piperidine is Cc1cccc(OC2CCNCC2)c1C.
What is the InChIKey of 4-(2,3-dimethylphenoxy)piperidine?
The InChIKey is SWOAHKOFKRMKBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-4-3-5-13(11(10)2)15-12-6-8-14-9-7-12/h3-5,12,14H,6-9H2,1-2H3.
What are the key properties of 4-(2,3-dimethylphenoxy)piperidine?
4-(2,3-dimethylphenoxy)piperidine has a molecular weight of 205.30 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylphenoxy)piperidine is sourced from PubChem (CID 24694567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).