4-naphthalen-2-yl-1-propylpiperidine

C18H23N — CID 71454276

IUPAC4-naphthalen-2-yl-1-propylpiperidine
SMILESCCCN1CCC(c2ccc3ccccc3c2)CC1
InChIInChI=1S/C18H23N/c1-2-11-19-12-9-16(10-13-19)18-8-7-15-5-3-4-6-17(15)14-18/h3-8,14,16H,2,9-13H2,1H3
InChIKeyJPFBKWSBTOFTQU-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.43
Rot. Bonds3

About 4-naphthalen-2-yl-1-propylpiperidine

4-naphthalen-2-yl-1-propylpiperidine (PubChem CID 71454276) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is 4-naphthalen-2-yl-1-propylpiperidine.

Molecular Properties

Compound Name4-naphthalen-2-yl-1-propylpiperidine
PubChem CID71454276
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC Name4-naphthalen-2-yl-1-propylpiperidine
SMILESCCCN1CCC(c2ccc3ccccc3c2)CC1
InChIInChI=1S/C18H23N/c1-2-11-19-12-9-16(10-13-19)18-8-7-15-5-3-4-6-17(15)14-18/h3-8,14,16H,2,9-13H2,1H3
InChIKeyJPFBKWSBTOFTQU-UHFFFAOYSA-N
XLogP4.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-2-yl-1-propylpiperidine?
The IUPAC name of 4-naphthalen-2-yl-1-propylpiperidine (CID 71454276) is 4-naphthalen-2-yl-1-propylpiperidine.
What is the SMILES notation for 4-naphthalen-2-yl-1-propylpiperidine?
The canonical SMILES for 4-naphthalen-2-yl-1-propylpiperidine is CCCN1CCC(c2ccc3ccccc3c2)CC1.
What is the InChIKey of 4-naphthalen-2-yl-1-propylpiperidine?
The InChIKey is JPFBKWSBTOFTQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-2-11-19-12-9-16(10-13-19)18-8-7-15-5-3-4-6-17(15)14-18/h3-8,14,16H,2,9-13H2,1H3.
What are the key properties of 4-naphthalen-2-yl-1-propylpiperidine?
4-naphthalen-2-yl-1-propylpiperidine has a molecular weight of 253.39 g/mol, XLogP of 4.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-2-yl-1-propylpiperidine is sourced from PubChem (CID 71454276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).