1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine

C15H32N2 — CID 55258928

IUPAC1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine
SMILESCCCCC(CC)CN1CCCC(C(C)N)C1
InChIInChI=1S/C15H32N2/c1-4-6-8-14(5-2)11-17-10-7-9-15(12-17)13(3)16/h13-15H,4-12,16H2,1-3H3
InChIKeyABOZZUFNSBKIRA-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.26
Rot. Bonds7

About 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine

1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine (PubChem CID 55258928) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine
PubChem CID55258928
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine
SMILESCCCCC(CC)CN1CCCC(C(C)N)C1
InChIInChI=1S/C15H32N2/c1-4-6-8-14(5-2)11-17-10-7-9-15(12-17)13(3)16/h13-15H,4-12,16H2,1-3H3
InChIKeyABOZZUFNSBKIRA-UHFFFAOYSA-N
XLogP3.26
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol
CID 55064618
4-(1-chloroethyl)-1-(2-ethylhexyl)piperidine
CID 106837967
1-[1-(2-cyclopentylethyl)piperidin-3-yl]ethanamine
CID 119925718
N-ethyl-1-(2-ethylhexyl)pyrrolidin-3-amine
CID 107815392
1-[1-(3-methoxy-2-methylpropyl)piperidin-3-yl]ethanamine
CID 116502167
1-(2-ethylhexyl)-3-methyl-1,4-diazepane
CID 64859197
1-(1-nonylpyrrolidin-3-yl)ethanamine
CID 113360760
4-bromo-1-(2-ethylhexyl)piperidine
CID 80678889
1-[1-[2-(4-fluorophenyl)propyl]piperidin-3-yl]ethanamine
CID 120841093
2-[1-(2-ethylhexyl)pyrrolidin-3-yl]ethanol
CID 104627914
1-(1-propylpyrrolidin-3-yl)ethanamine
CID 83981022
1-(2-ethylhexyl)-4,6-dimethyl-1,5-diazocane
CID 107817900

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine?
The IUPAC name of 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine (CID 55258928) is 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine.
What is the SMILES notation for 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine?
The canonical SMILES for 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine is CCCCC(CC)CN1CCCC(C(C)N)C1.
What is the InChIKey of 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine?
The InChIKey is ABOZZUFNSBKIRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-4-6-8-14(5-2)11-17-10-7-9-15(12-17)13(3)16/h13-15H,4-12,16H2,1-3H3.
What are the key properties of 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine?
1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine has a molecular weight of 240.43 g/mol, XLogP of 3.26, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine is sourced from PubChem (CID 55258928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).