1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine

C15H32N2O3 — CID 104560351

IUPAC1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine
SMILESCCCCOCCOCCOCCN1CCC(N)CC1
InChIInChI=1S/C15H32N2O3/c1-2-3-9-18-11-13-20-14-12-19-10-8-17-6-4-15(16)5-7-17/h15H,2-14,16H2,1H3
InChIKeyBKLRKFGDKLIVKN-UHFFFAOYSA-N
MW288.43 g/mol
LogP1.26
Rot. Bonds12

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

1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine (PubChem CID 104560351) has the molecular formula C15H32N2O3 and a molecular weight of 288.43 g/mol. Its IUPAC name is 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine
PubChem CID104560351
Molecular FormulaC15H32N2O3
Molecular Weight288.43 g/mol
Exact Mass288.24
IUPAC Name1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine
SMILESCCCCOCCOCCOCCN1CCC(N)CC1
InChIInChI=1S/C15H32N2O3/c1-2-3-9-18-11-13-20-14-12-19-10-8-17-6-4-15(16)5-7-17/h15H,2-14,16H2,1H3
InChIKeyBKLRKFGDKLIVKN-UHFFFAOYSA-N
XLogP1.26
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[2-[2-(2-butoxyethoxy)ethoxy]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-(5-propoxypentyl)piperidin-4-amine
CID 18002201
1-[2-(3-methoxypropoxy)ethyl]piperidin-4-amine
CID 103177226
1-(2-butoxyethyl)azetidin-3-amine
CID 63760521
1-(3-ethoxypropyl)piperidin-4-amine
CID 18001948
ethane;1-pentylpiperidin-4-amine
CID 142516102
1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-N-methylpiperidin-4-amine
CID 104560353
1-[2-(2-aminoethoxy)ethyl]piperidin-4-amine;ethane
CID 156883236
1-(2-butoxyethyl)piperidin-4-ol
CID 61067988
1-[2-[2-(4-ethylpiperidin-1-yl)ethoxy]ethyl]pyrrolidin-3-amine
CID 163451495
2-[1-(2-butoxyethyl)pyrrolidin-3-yl]ethanamine
CID 114802527
1-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethyl]-N-propan-2-ylpiperidin-4-amine
CID 155405108
3-(bromomethyl)-1-(2-butoxyethyl)pyrrolidine
CID 80691458

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine?
The IUPAC name of 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine (CID 104560351) is 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine.
What is the SMILES notation for 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine?
The canonical SMILES for 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine is CCCCOCCOCCOCCN1CCC(N)CC1.
What is the InChIKey of 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine?
The InChIKey is BKLRKFGDKLIVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O3/c1-2-3-9-18-11-13-20-14-12-19-10-8-17-6-4-15(16)5-7-17/h15H,2-14,16H2,1H3.
What are the key properties of 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine?
1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine has a molecular weight of 288.43 g/mol, XLogP of 1.26, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]piperidin-4-amine is sourced from PubChem (CID 104560351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).