1-(naphthalen-1-ylmethyl)piperidin-3-ol

C16H19NO — CID 2837989

IUPAC1-(naphthalen-1-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C16H19NO/c18-15-8-4-10-17(12-15)11-14-7-3-6-13-5-1-2-9-16(13)14/h1-3,5-7,9,15,18H,4,8,10-12H2
InChIKeyYEZFYEJRKPRXID-UHFFFAOYSA-N
MW241.33 g/mol
LogP2.80
Rot. Bonds2

About 1-(naphthalen-1-ylmethyl)piperidin-3-ol

1-(naphthalen-1-ylmethyl)piperidin-3-ol (PubChem CID 2837989) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-(naphthalen-1-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(naphthalen-1-ylmethyl)piperidin-3-ol
PubChem CID2837989
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name1-(naphthalen-1-ylmethyl)piperidin-3-ol
SMILESOC1CCCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C16H19NO/c18-15-8-4-10-17(12-15)11-14-7-3-6-13-5-1-2-9-16(13)14/h1-3,5-7,9,15,18H,4,8,10-12H2
InChIKeyYEZFYEJRKPRXID-UHFFFAOYSA-N
XLogP2.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(naphthalen-1-ylmethyl)piperidin-3-ol?
The IUPAC name of 1-(naphthalen-1-ylmethyl)piperidin-3-ol (CID 2837989) is 1-(naphthalen-1-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 1-(naphthalen-1-ylmethyl)piperidin-3-ol?
The canonical SMILES for 1-(naphthalen-1-ylmethyl)piperidin-3-ol is OC1CCCN(Cc2cccc3ccccc23)C1.
What is the InChIKey of 1-(naphthalen-1-ylmethyl)piperidin-3-ol?
The InChIKey is YEZFYEJRKPRXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c18-15-8-4-10-17(12-15)11-14-7-3-6-13-5-1-2-9-16(13)14/h1-3,5-7,9,15,18H,4,8,10-12H2.
What are the key properties of 1-(naphthalen-1-ylmethyl)piperidin-3-ol?
1-(naphthalen-1-ylmethyl)piperidin-3-ol has a molecular weight of 241.33 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(naphthalen-1-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 2837989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).