6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one

C15H19NO2 — CID 156888968

IUPAC6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one
SMILESO=C1c2ccc(O)cc2CCC1C1CCNCC1
InChIInChI=1S/C15H19NO2/c17-12-2-4-14-11(9-12)1-3-13(15(14)18)10-5-7-16-8-6-10/h2,4,9-10,13,16-17H,1,3,5-8H2
InChIKeyKOCCZSDCBPXEKB-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.14
Rot. Bonds1

About 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one

6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one (PubChem CID 156888968) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one.

Molecular Properties

Compound Name6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one
PubChem CID156888968
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one
SMILESO=C1c2ccc(O)cc2CCC1C1CCNCC1
InChIInChI=1S/C15H19NO2/c17-12-2-4-14-11(9-12)1-3-13(15(14)18)10-5-7-16-8-6-10/h2,4,9-10,13,16-17H,1,3,5-8H2
InChIKeyKOCCZSDCBPXEKB-UHFFFAOYSA-N
XLogP2.14
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one?
The IUPAC name of 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one (CID 156888968) is 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one.
What is the SMILES notation for 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one?
The canonical SMILES for 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one is O=C1c2ccc(O)cc2CCC1C1CCNCC1.
What is the InChIKey of 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one?
The InChIKey is KOCCZSDCBPXEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c17-12-2-4-14-11(9-12)1-3-13(15(14)18)10-5-7-16-8-6-10/h2,4,9-10,13,16-17H,1,3,5-8H2.
What are the key properties of 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one?
6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one has a molecular weight of 245.32 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-2-piperidin-4-yl-3,4-dihydro-2H-naphthalen-1-one is sourced from PubChem (CID 156888968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).