1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine

C15H24N2O — CID 28802683

IUPAC1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine
SMILESCc1ccc(OCCN2CCC(N)CC2)c(C)c1
InChIInChI=1S/C15H24N2O/c1-12-3-4-15(13(2)11-12)18-10-9-17-7-5-14(16)6-8-17/h3-4,11,14H,5-10,16H2,1-2H3
InChIKeyVBSZXWNTXZPNAA-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.11
Rot. Bonds4

About 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine

1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine (PubChem CID 28802683) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine
PubChem CID28802683
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine
SMILESCc1ccc(OCCN2CCC(N)CC2)c(C)c1
InChIInChI=1S/C15H24N2O/c1-12-3-4-15(13(2)11-12)18-10-9-17-7-5-14(16)6-8-17/h3-4,11,14H,5-10,16H2,1-2H3
InChIKeyVBSZXWNTXZPNAA-UHFFFAOYSA-N
XLogP2.11
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine 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-[2-(2,4-dimethylphenoxy)ethyl]piperidine-4-carbonitrile
CID 39359832
1-[2-[2-(2,4-dimethylphenoxy)ethoxy]ethyl]pyrrolidine
CID 3870944
4-[1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-yl]-1H-pyridin-2-one
CID 138384771
(3S)-1-[3-(2,5-dimethylphenoxy)propyl]pyrrolidin-3-amine
CID 81491707
(R)-[1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 124751770
1-(4-aminopiperidin-1-yl)-2-(2,4-dimethylphenoxy)ethanone;hydrochloride
CID 119375533
1-(2-ethoxy-5-methylphenyl)piperidin-4-amine
CID 55063114
1-[2-(2,6-dimethylphenoxy)ethyl]piperidin-4-amine;hydrochloride
CID 120965850
1-[2-(2,5-dimethylphenoxy)ethyl]piperidin-3-amine
CID 61295726
1-(4-ethoxy-3-methylphenyl)piperidin-4-amine
CID 63214437
2-[2-(azepan-1-yl)ethoxy]-5-methylaniline;dihydrochloride
CID 46736515
ethyl 1-[2-(4-chloro-2-methylphenoxy)ethyl]piperidine-4-carboxylate
CID 6458009

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine?
The IUPAC name of 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine (CID 28802683) is 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine?
The canonical SMILES for 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine is Cc1ccc(OCCN2CCC(N)CC2)c(C)c1.
What is the InChIKey of 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine?
The InChIKey is VBSZXWNTXZPNAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-3-4-15(13(2)11-12)18-10-9-17-7-5-14(16)6-8-17/h3-4,11,14H,5-10,16H2,1-2H3.
What are the key properties of 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine?
1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-amine is sourced from PubChem (CID 28802683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).