(8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone

C16H17NO2 — CID 660137

IUPAC(8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone
SMILESO=C(c1cccc2cccc(O)c12)N1CCCCC1
InChIInChI=1S/C16H17NO2/c18-14-9-5-7-12-6-4-8-13(15(12)14)16(19)17-10-2-1-3-11-17/h4-9,18H,1-3,10-11H2
InChIKeyDMJXLYWDORKYNG-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.17
Rot. Bonds1

About (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone

(8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone (PubChem CID 660137) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone
PubChem CID660137
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name(8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone
SMILESO=C(c1cccc2cccc(O)c12)N1CCCCC1
InChIInChI=1S/C16H17NO2/c18-14-9-5-7-12-6-4-8-13(15(12)14)16(19)17-10-2-1-3-11-17/h4-9,18H,1-3,10-11H2
InChIKeyDMJXLYWDORKYNG-UHFFFAOYSA-N
XLogP3.17
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-(azepane-1-carbonyl)naphthalene-1-carboxylic acid
CID 16776667
8-(pyrrolidine-1-carbonyl)naphthalene-1-carboxylic acid
CID 16773543
(2,2-difluoro-5-azaspiro[2.3]hexan-5-yl)-(8-hydroxynaphthalen-1-yl)methanone
CID 138057670
8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide
CID 25044324
(2-aminophenyl)-piperidin-1-ylmethanone
CID 558730
piperidin-1-yl-(2,3,4-trihydroxyphenyl)methanone
CID 139689165
2-(piperidine-1-carbonyl)phenolate
CID 101121314
azepan-1-yl-(2-methylphenyl)methanone
CID 4616576
(2-iodophenyl)-piperidin-1-ylmethanone
CID 962070
(2-aminophenyl)-(azepan-1-yl)methanone
CID 726247
azepan-1-yl-(3-chloro-2-fluorophenyl)methanone
CID 80949460
azepan-1-yl-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 27659108

Frequently Asked Questions

What is the IUPAC name of (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone?
The IUPAC name of (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone (CID 660137) is (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone is O=C(c1cccc2cccc(O)c12)N1CCCCC1.
What is the InChIKey of (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone?
The InChIKey is DMJXLYWDORKYNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c18-14-9-5-7-12-6-4-8-13(15(12)14)16(19)17-10-2-1-3-11-17/h4-9,18H,1-3,10-11H2.
What are the key properties of (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone?
(8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone has a molecular weight of 255.32 g/mol, XLogP of 3.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 660137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).