3-methyl-4-naphthalen-2-ylpiperidine

C16H19N — CID 66277961

IUPAC3-methyl-4-naphthalen-2-ylpiperidine
SMILESCC1CNCCC1c1ccc2ccccc2c1
InChIInChI=1S/C16H19N/c1-12-11-17-9-8-16(12)15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10,12,16-17H,8-9,11H2,1H3
InChIKeyBVRPGPQKKONWEB-UHFFFAOYSA-N
MW225.34 g/mol
LogP3.55
Rot. Bonds1

About 3-methyl-4-naphthalen-2-ylpiperidine

3-methyl-4-naphthalen-2-ylpiperidine (PubChem CID 66277961) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is 3-methyl-4-naphthalen-2-ylpiperidine.

Molecular Properties

Compound Name3-methyl-4-naphthalen-2-ylpiperidine
PubChem CID66277961
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC Name3-methyl-4-naphthalen-2-ylpiperidine
SMILESCC1CNCCC1c1ccc2ccccc2c1
InChIInChI=1S/C16H19N/c1-12-11-17-9-8-16(12)15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10,12,16-17H,8-9,11H2,1H3
InChIKeyBVRPGPQKKONWEB-UHFFFAOYSA-N
XLogP3.55
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-naphthalen-2-ylpiperidine?
The IUPAC name of 3-methyl-4-naphthalen-2-ylpiperidine (CID 66277961) is 3-methyl-4-naphthalen-2-ylpiperidine.
What is the SMILES notation for 3-methyl-4-naphthalen-2-ylpiperidine?
The canonical SMILES for 3-methyl-4-naphthalen-2-ylpiperidine is CC1CNCCC1c1ccc2ccccc2c1.
What is the InChIKey of 3-methyl-4-naphthalen-2-ylpiperidine?
The InChIKey is BVRPGPQKKONWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-12-11-17-9-8-16(12)15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10,12,16-17H,8-9,11H2,1H3.
What are the key properties of 3-methyl-4-naphthalen-2-ylpiperidine?
3-methyl-4-naphthalen-2-ylpiperidine has a molecular weight of 225.34 g/mol, XLogP of 3.55, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-naphthalen-2-ylpiperidine is sourced from PubChem (CID 66277961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).