1-naphthalen-2-ylpiperazine

C14H16N2 — CID 2760172

IUPAC1-naphthalen-2-ylpiperazine
SMILESc1ccc2cc(N3CCNCC3)ccc2c1
InChIInChI=1S/C14H16N2/c1-2-4-13-11-14(6-5-12(13)3-1)16-9-7-15-8-10-16/h1-6,11,15H,7-10H2
InChIKeyLWLBVIFUVSUSAY-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.25
Rot. Bonds1

About 1-naphthalen-2-ylpiperazine

1-naphthalen-2-ylpiperazine (PubChem CID 2760172) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 1-naphthalen-2-ylpiperazine.

Molecular Properties

Compound Name1-naphthalen-2-ylpiperazine
PubChem CID2760172
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name1-naphthalen-2-ylpiperazine
SMILESc1ccc2cc(N3CCNCC3)ccc2c1
InChIInChI=1S/C14H16N2/c1-2-4-13-11-14(6-5-12(13)3-1)16-9-7-15-8-10-16/h1-6,11,15H,7-10H2
InChIKeyLWLBVIFUVSUSAY-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-ylpiperazine?
The IUPAC name of 1-naphthalen-2-ylpiperazine (CID 2760172) is 1-naphthalen-2-ylpiperazine.
What is the SMILES notation for 1-naphthalen-2-ylpiperazine?
The canonical SMILES for 1-naphthalen-2-ylpiperazine is c1ccc2cc(N3CCNCC3)ccc2c1.
What is the InChIKey of 1-naphthalen-2-ylpiperazine?
The InChIKey is LWLBVIFUVSUSAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-2-4-13-11-14(6-5-12(13)3-1)16-9-7-15-8-10-16/h1-6,11,15H,7-10H2.
What are the key properties of 1-naphthalen-2-ylpiperazine?
1-naphthalen-2-ylpiperazine has a molecular weight of 212.30 g/mol, XLogP of 2.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-ylpiperazine is sourced from PubChem (CID 2760172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).