(3S)-3-(naphthalen-2-yloxymethyl)piperidine

C16H19NO — CID 26190856

IUPAC(3S)-3-(naphthalen-2-yloxymethyl)piperidine
SMILESc1ccc2cc(OC[C@H]3CCCNC3)ccc2c1
InChIInChI=1S/C16H19NO/c1-2-6-15-10-16(8-7-14(15)5-1)18-12-13-4-3-9-17-11-13/h1-2,5-8,10,13,17H,3-4,9,11-12H2/t13-/m0/s1
InChIKeyZEKZSUIMQDHJKA-ZDUSSCGKSA-N
MW241.33 g/mol
LogP3.22
Rot. Bonds3

About (3S)-3-(naphthalen-2-yloxymethyl)piperidine

(3S)-3-(naphthalen-2-yloxymethyl)piperidine (PubChem CID 26190856) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is (3S)-3-(naphthalen-2-yloxymethyl)piperidine.

Molecular Properties

Compound Name(3S)-3-(naphthalen-2-yloxymethyl)piperidine
PubChem CID26190856
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name(3S)-3-(naphthalen-2-yloxymethyl)piperidine
SMILESc1ccc2cc(OC[C@H]3CCCNC3)ccc2c1
InChIInChI=1S/C16H19NO/c1-2-6-15-10-16(8-7-14(15)5-1)18-12-13-4-3-9-17-11-13/h1-2,5-8,10,13,17H,3-4,9,11-12H2/t13-/m0/s1
InChIKeyZEKZSUIMQDHJKA-ZDUSSCGKSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-(naphthalen-2-yloxymethyl)piperidine
CID 26190858
(3S)-3-(phenoxymethyl)piperidine
CID 26190643
(3S)-3-[(4-phenylphenoxy)methyl]piperidine
CID 42427138
(3R)-3-[(3,4-dichlorophenoxy)methyl]piperidine
CID 26190720
5-(piperidin-3-ylmethoxy)-1H-indazole
CID 117051742
(3S)-3-[(4-fluorophenoxy)methyl]piperidine
CID 42427122
(3R)-3-[(3-fluorophenoxy)methyl]piperidine
CID 26188571
(3S)-3-(2,3-dihydro-1H-inden-5-yloxymethyl)piperidine
CID 42427116
(3S)-3-[(3-fluorophenoxy)methyl]piperidine
CID 26188575
3-[[(3S)-piperidin-3-yl]methoxy]benzonitrile
CID 93481139
3-(2-naphthalen-2-ylethoxymethyl)piperidine
CID 44784862
(3R)-3-[(4-chloro-3-methylphenoxy)methyl]piperidine
CID 28750104

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(naphthalen-2-yloxymethyl)piperidine?
The IUPAC name of (3S)-3-(naphthalen-2-yloxymethyl)piperidine (CID 26190856) is (3S)-3-(naphthalen-2-yloxymethyl)piperidine.
What is the SMILES notation for (3S)-3-(naphthalen-2-yloxymethyl)piperidine?
The canonical SMILES for (3S)-3-(naphthalen-2-yloxymethyl)piperidine is c1ccc2cc(OC[C@H]3CCCNC3)ccc2c1.
What is the InChIKey of (3S)-3-(naphthalen-2-yloxymethyl)piperidine?
The InChIKey is ZEKZSUIMQDHJKA-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H19NO/c1-2-6-15-10-16(8-7-14(15)5-1)18-12-13-4-3-9-17-11-13/h1-2,5-8,10,13,17H,3-4,9,11-12H2/t13-/m0/s1.
What are the key properties of (3S)-3-(naphthalen-2-yloxymethyl)piperidine?
(3S)-3-(naphthalen-2-yloxymethyl)piperidine has a molecular weight of 241.33 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(naphthalen-2-yloxymethyl)piperidine is sourced from PubChem (CID 26190856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).