1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol

C15H23NO — CID 764714

IUPAC1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol
SMILESCC(C)c1ccc(CN2CCC(O)CC2)cc1
InChIInChI=1S/C15H23NO/c1-12(2)14-5-3-13(4-6-14)11-16-9-7-15(17)8-10-16/h3-6,12,15,17H,7-11H2,1-2H3
InChIKeyCFAILTWQQPILFW-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.77
Rot. Bonds3

About 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol

1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol (PubChem CID 764714) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol
PubChem CID764714
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol
SMILESCC(C)c1ccc(CN2CCC(O)CC2)cc1
InChIInChI=1S/C15H23NO/c1-12(2)14-5-3-13(4-6-14)11-16-9-7-15(17)8-10-16/h3-6,12,15,17H,7-11H2,1-2H3
InChIKeyCFAILTWQQPILFW-UHFFFAOYSA-N
XLogP2.77
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 ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol (CID 764714) is 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol is CC(C)c1ccc(CN2CCC(O)CC2)cc1.
What is the InChIKey of 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol?
The InChIKey is CFAILTWQQPILFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12(2)14-5-3-13(4-6-14)11-16-9-7-15(17)8-10-16/h3-6,12,15,17H,7-11H2,1-2H3.
What are the key properties of 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol?
1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol has a molecular weight of 233.36 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-propan-2-ylphenyl)methyl]piperidin-4-ol is sourced from PubChem (CID 764714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).