4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol

C15H24N2O — CID 55169337

IUPAC4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol
SMILESCC(N)C1CCCCN1C(C)c1ccc(O)cc1
InChIInChI=1S/C15H24N2O/c1-11(16)15-5-3-4-10-17(15)12(2)13-6-8-14(18)9-7-13/h6-9,11-12,15,18H,3-5,10,16H2,1-2H3
InChIKeyYZMOPZXMOUVCQX-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.65
Rot. Bonds3

About 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol

4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol (PubChem CID 55169337) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol.

Molecular Properties

Compound Name4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol
PubChem CID55169337
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol
SMILESCC(N)C1CCCCN1C(C)c1ccc(O)cc1
InChIInChI=1S/C15H24N2O/c1-11(16)15-5-3-4-10-17(15)12(2)13-6-8-14(18)9-7-13/h6-9,11-12,15,18H,3-5,10,16H2,1-2H3
InChIKeyYZMOPZXMOUVCQX-UHFFFAOYSA-N
XLogP2.65
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[1-(4-ethylphenyl)ethyl]piperidin-2-yl]ethanamine
CID 63254747
4-[2-[2-(1-aminoethyl)piperidin-1-yl]propyl]phenol
CID 115496086
4-[[2-(1-aminoethyl)piperidin-1-yl]methyl]phenol
CID 63254190
1-[1-[1-(1-ethylpyrazol-4-yl)ethyl]piperidin-2-yl]ethanamine
CID 63255319
methyl (2S)-2-[(2S)-1-[(1R)-1-phenylethyl]piperidin-2-yl]propanoate
CID 50901624
1-[2-(1-aminoethyl)piperidin-1-yl]-2-(4-hydroxyphenyl)ethanone
CID 63255198
2-[2-(1-aminoethyl)piperidin-1-yl]propan-1-ol
CID 130502556
1-[1-[1-(1-benzofuran-2-yl)ethyl]piperidin-2-yl]ethanamine
CID 63254702
1-[1-[1-(1,3-thiazol-2-yl)ethyl]piperidin-2-yl]ethanamine
CID 64990466
4-[1-(2-propan-2-ylpyrrolidin-1-yl)propyl]phenol
CID 82983105
4-[2-amino-1-[1-(2-methylpropyl)piperidin-2-yl]ethyl]phenol
CID 83987245
(2S)-1-[(1S)-1-(4-iodophenyl)ethyl]-2-methylpiperidine
CID 59890825

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol?
The IUPAC name of 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol (CID 55169337) is 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol.
What is the SMILES notation for 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol?
The canonical SMILES for 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol is CC(N)C1CCCCN1C(C)c1ccc(O)cc1.
What is the InChIKey of 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol?
The InChIKey is YZMOPZXMOUVCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(16)15-5-3-4-10-17(15)12(2)13-6-8-14(18)9-7-13/h6-9,11-12,15,18H,3-5,10,16H2,1-2H3.
What are the key properties of 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol?
4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol has a molecular weight of 248.37 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-(1-aminoethyl)piperidin-1-yl]ethyl]phenol is sourced from PubChem (CID 55169337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).