(2S)-2-(naphthalen-2-ylmethyl)piperidine

C16H19N — CID 94603397

IUPAC(2S)-2-(naphthalen-2-ylmethyl)piperidine
SMILESc1ccc2cc(C[C@@H]3CCCCN3)ccc2c1
InChIInChI=1S/C16H19N/c1-2-6-15-11-13(8-9-14(15)5-1)12-16-7-3-4-10-17-16/h1-2,5-6,8-9,11,16-17H,3-4,7,10,12H2/t16-/m0/s1
InChIKeyRMQYSLRDQOJEGW-INIZCTEOSA-N
MW225.34 g/mol
LogP3.52
Rot. Bonds2

About (2S)-2-(naphthalen-2-ylmethyl)piperidine

(2S)-2-(naphthalen-2-ylmethyl)piperidine (PubChem CID 94603397) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is (2S)-2-(naphthalen-2-ylmethyl)piperidine.

Molecular Properties

Compound Name(2S)-2-(naphthalen-2-ylmethyl)piperidine
PubChem CID94603397
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC Name(2S)-2-(naphthalen-2-ylmethyl)piperidine
SMILESc1ccc2cc(C[C@@H]3CCCCN3)ccc2c1
InChIInChI=1S/C16H19N/c1-2-6-15-11-13(8-9-14(15)5-1)12-16-7-3-4-10-17-16/h1-2,5-6,8-9,11,16-17H,3-4,7,10,12H2/t16-/m0/s1
InChIKeyRMQYSLRDQOJEGW-INIZCTEOSA-N
XLogP3.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-ylmethyl)piperidine
CID 117360963
(2R)-2-(naphthalen-2-yloxymethyl)piperidine
CID 26192553
6-(piperidin-2-ylmethyl)-1,2-benzoxazole
CID 117308307
2-[(2-methyl-1-benzofuran-5-yl)methyl]piperidine
CID 117331068
5-(piperidin-2-ylmethyl)-1,2-benzoxazole
CID 117308308
2-[(3-chlorophenyl)methyl]azepane
CID 5094056
6-(pyrrolidin-2-ylmethyl)-1H-indole
CID 10198107
2-[(3-fluorophenyl)methyl]azepane
CID 62544707
(2R)-2-[(4-methylphenyl)methyl]piperidine
CID 7048103
(2R)-2-(1-benzofuran-2-ylmethyl)piperidine
CID 94859293
N-methyl-N-(naphthalen-2-ylmethyl)-2-pyrrolidin-2-ylethanamine
CID 115210395
2-[(4-methoxy-3-phenylphenyl)methyl]piperidine
CID 117451820

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(naphthalen-2-ylmethyl)piperidine?
The IUPAC name of (2S)-2-(naphthalen-2-ylmethyl)piperidine (CID 94603397) is (2S)-2-(naphthalen-2-ylmethyl)piperidine.
What is the SMILES notation for (2S)-2-(naphthalen-2-ylmethyl)piperidine?
The canonical SMILES for (2S)-2-(naphthalen-2-ylmethyl)piperidine is c1ccc2cc(C[C@@H]3CCCCN3)ccc2c1.
What is the InChIKey of (2S)-2-(naphthalen-2-ylmethyl)piperidine?
The InChIKey is RMQYSLRDQOJEGW-INIZCTEOSA-N. The full InChI is InChI=1S/C16H19N/c1-2-6-15-11-13(8-9-14(15)5-1)12-16-7-3-4-10-17-16/h1-2,5-6,8-9,11,16-17H,3-4,7,10,12H2/t16-/m0/s1.
What are the key properties of (2S)-2-(naphthalen-2-ylmethyl)piperidine?
(2S)-2-(naphthalen-2-ylmethyl)piperidine has a molecular weight of 225.34 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(naphthalen-2-ylmethyl)piperidine is sourced from PubChem (CID 94603397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).