1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine

C16H26N2O2 — CID 43556436

IUPAC1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine
SMILESCCCOc1ccc(OCCN2CCC(N)CC2)cc1
InChIInChI=1S/C16H26N2O2/c1-2-12-19-15-3-5-16(6-4-15)20-13-11-18-9-7-14(17)8-10-18/h3-6,14H,2,7-13,17H2,1H3
InChIKeyGIHHQXDGAUQDPP-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.28
Rot. Bonds7

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

1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine (PubChem CID 43556436) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine
PubChem CID43556436
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine
SMILESCCCOc1ccc(OCCN2CCC(N)CC2)cc1
InChIInChI=1S/C16H26N2O2/c1-2-12-19-15-3-5-16(6-4-15)20-13-11-18-9-7-14(17)8-10-18/h3-6,14H,2,7-13,17H2,1H3
InChIKeyGIHHQXDGAUQDPP-UHFFFAOYSA-N
XLogP2.28
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(4-propoxyphenoxy)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-(4-propoxyphenoxy)ethyl]pyrrolidin-3-yl]methanamine
CID 62063950
(3S)-1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidin-3-amine;hydrochloride
CID 119933726
1-[2-(4-propoxyphenoxy)ethyl]piperidine-4-carboxylic acid
CID 119908222
1-[2-(4-propoxyphenoxy)ethyl]piperidine;hydrochloride
CID 3030633
N-methyl-1-[1-[2-(4-propoxyphenoxy)ethyl]pyrrolidin-3-yl]methanamine;hydrochloride
CID 119921928
1-[2-(4-bromophenoxy)ethyl]-4-ethylpiperidine
CID 63456489
1-(4-propoxyphenyl)pyrrolidin-3-amine
CID 62329191
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
(3S)-3-methyl-1-[2-(4-propoxyphenoxy)ethyl]piperidine
CID 2182296
1-(4-propoxyphenyl)sulfonylpiperidin-4-amine;hydrochloride
CID 119959067
4-methyl-1-[2-(4-propoxyphenoxy)ethyl]pyrrolidin-3-amine
CID 103576883
4-[3-(4-aminopiperidin-1-yl)propoxy]benzoic acid
CID 129300145

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine?
The IUPAC name of 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine (CID 43556436) is 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine?
The canonical SMILES for 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine is CCCOc1ccc(OCCN2CCC(N)CC2)cc1.
What is the InChIKey of 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine?
The InChIKey is GIHHQXDGAUQDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-2-12-19-15-3-5-16(6-4-15)20-13-11-18-9-7-14(17)8-10-18/h3-6,14H,2,7-13,17H2,1H3.
What are the key properties of 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine?
1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 2.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-propoxyphenoxy)ethyl]piperidin-4-amine is sourced from PubChem (CID 43556436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).