[1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol

C15H24N2O2 — CID 55021694

IUPAC[1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol
SMILESCOc1ccccc1C(CN)N1CCCCC1CO
InChIInChI=1S/C15H24N2O2/c1-19-15-8-3-2-7-13(15)14(10-16)17-9-5-4-6-12(17)11-18/h2-3,7-8,12,14,18H,4-6,9-11,16H2,1H3
InChIKeyMTRPFITUOORSLE-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.54
Rot. Bonds5

About [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol

[1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol (PubChem CID 55021694) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol
PubChem CID55021694
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol
SMILESCOc1ccccc1C(CN)N1CCCCC1CO
InChIInChI=1S/C15H24N2O2/c1-19-15-8-3-2-7-13(15)14(10-16)17-9-5-4-6-12(17)11-18/h2-3,7-8,12,14,18H,4-6,9-11,16H2,1H3
InChIKeyMTRPFITUOORSLE-UHFFFAOYSA-N
XLogP1.54
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol?
The IUPAC name of [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol (CID 55021694) is [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol.
What is the SMILES notation for [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol?
The canonical SMILES for [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol is COc1ccccc1C(CN)N1CCCCC1CO.
What is the InChIKey of [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol?
The InChIKey is MTRPFITUOORSLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-19-15-8-3-2-7-13(15)14(10-16)17-9-5-4-6-12(17)11-18/h2-3,7-8,12,14,18H,4-6,9-11,16H2,1H3.
What are the key properties of [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol?
[1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-amino-1-(2-methoxyphenyl)ethyl]piperidin-2-yl]methanol is sourced from PubChem (CID 55021694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).