2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol

C15H23NO — CID 117339041

IUPAC2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol
SMILESCc1ccc(N2CCCCC2)c(C(C)CO)c1
InChIInChI=1S/C15H23NO/c1-12-6-7-15(14(10-12)13(2)11-17)16-8-4-3-5-9-16/h6-7,10,13,17H,3-5,8-9,11H2,1-2H3
InChIKeyGVFUXRQWZMQHOZ-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.08
Rot. Bonds3

About 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol

2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol (PubChem CID 117339041) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol
PubChem CID117339041
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol
SMILESCc1ccc(N2CCCCC2)c(C(C)CO)c1
InChIInChI=1S/C15H23NO/c1-12-6-7-15(14(10-12)13(2)11-17)16-8-4-3-5-9-16/h6-7,10,13,17H,3-5,8-9,11H2,1-2H3
InChIKeyGVFUXRQWZMQHOZ-UHFFFAOYSA-N
XLogP3.08
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol?
The IUPAC name of 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol (CID 117339041) is 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol.
What is the SMILES notation for 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol?
The canonical SMILES for 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol is Cc1ccc(N2CCCCC2)c(C(C)CO)c1.
What is the InChIKey of 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol?
The InChIKey is GVFUXRQWZMQHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-6-7-15(14(10-12)13(2)11-17)16-8-4-3-5-9-16/h6-7,10,13,17H,3-5,8-9,11H2,1-2H3.
What are the key properties of 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol?
2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol has a molecular weight of 233.36 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol is sourced from PubChem (CID 117339041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).