4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol

C15H24N2O2 — CID 84748251

IUPAC4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol
SMILESCOc1cc(CC(C)(N)N2CCCCC2)ccc1O
InChIInChI=1S/C15H24N2O2/c1-15(16,17-8-4-3-5-9-17)11-12-6-7-13(18)14(10-12)19-2/h6-7,10,18H,3-5,8-9,11,16H2,1-2H3
InChIKeyWENAHAHHHHTBKG-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.10
Rot. Bonds4

About 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol

4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol (PubChem CID 84748251) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol.

Molecular Properties

Compound Name4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol
PubChem CID84748251
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol
SMILESCOc1cc(CC(C)(N)N2CCCCC2)ccc1O
InChIInChI=1S/C15H24N2O2/c1-15(16,17-8-4-3-5-9-17)11-12-6-7-13(18)14(10-12)19-2/h6-7,10,18H,3-5,8-9,11,16H2,1-2H3
InChIKeyWENAHAHHHHTBKG-UHFFFAOYSA-N
XLogP2.10
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol?
The IUPAC name of 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol (CID 84748251) is 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol.
What is the SMILES notation for 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol?
The canonical SMILES for 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol is COc1cc(CC(C)(N)N2CCCCC2)ccc1O.
What is the InChIKey of 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol?
The InChIKey is WENAHAHHHHTBKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(16,17-8-4-3-5-9-17)11-12-6-7-13(18)14(10-12)19-2/h6-7,10,18H,3-5,8-9,11,16H2,1-2H3.
What are the key properties of 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol?
4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol has a molecular weight of 264.37 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-piperidin-1-ylpropyl)-2-methoxyphenol is sourced from PubChem (CID 84748251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).