1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine

C15H23NO — CID 175842884

IUPAC1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine
SMILESCOc1ccc(C)c(CCN2CCCCC2)c1
InChIInChI=1S/C15H23NO/c1-13-6-7-15(17-2)12-14(13)8-11-16-9-4-3-5-10-16/h6-7,12H,3-5,8-11H2,1-2H3
InChIKeyROHFGMOQNBXSJW-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.03
Rot. Bonds4

About 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine

1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine (PubChem CID 175842884) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine.

Molecular Properties

Compound Name1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine
PubChem CID175842884
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine
SMILESCOc1ccc(C)c(CCN2CCCCC2)c1
InChIInChI=1S/C15H23NO/c1-13-6-7-15(17-2)12-14(13)8-11-16-9-4-3-5-10-16/h6-7,12H,3-5,8-11H2,1-2H3
InChIKeyROHFGMOQNBXSJW-UHFFFAOYSA-N
XLogP3.03
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine with MolForge

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

Launch Full Analysis

Related Compounds

1-[3-(4-methoxyphenyl)propyl]piperidine
CID 42640027
2-[2-(azepan-1-ylmethyl)-4-methoxyphenyl]ethanamine
CID 170868855
N-[(2-fluoro-4-methoxyphenyl)methyl]-2-piperidin-1-ylethanamine
CID 102876339
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
1-[2-(3,4-dimethylphenoxy)ethyl]azepane
CID 82086608
1-[(2-fluoro-5-methoxyphenyl)methyl]piperidine
CID 22372485
2,4-dimethoxy-N-(3-piperidin-1-ylpropyl)aniline
CID 82093801
4-(5-methoxy-2-methylphenyl)butan-1-amine
CID 66581549
[2-(azepan-1-ylmethyl)-4-methoxyphenyl]boronic acid
CID 65323323
1-[6-(4-methoxyphenyl)hexyl]piperidine
CID 129295861
N-[2-(azepan-1-yl)ethyl]-3-methoxyaniline
CID 54807048
4-methoxy-2-[(3-pyrrolidin-1-ylpropylamino)methyl]phenol
CID 28658335

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine?
The IUPAC name of 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine (CID 175842884) is 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine.
What is the SMILES notation for 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine?
The canonical SMILES for 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine is COc1ccc(C)c(CCN2CCCCC2)c1.
What is the InChIKey of 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine?
The InChIKey is ROHFGMOQNBXSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-13-6-7-15(17-2)12-14(13)8-11-16-9-4-3-5-10-16/h6-7,12H,3-5,8-11H2,1-2H3.
What are the key properties of 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine?
1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine has a molecular weight of 233.35 g/mol, XLogP of 3.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-methoxy-2-methylphenyl)ethyl]piperidine is sourced from PubChem (CID 175842884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).