1-(naphthalen-2-ylmethyl)piperazine

C15H18N2 — CID 910537

IUPAC1-(naphthalen-2-ylmethyl)piperazine
SMILESc1ccc2cc(CN3CCNCC3)ccc2c1
InChIInChI=1S/C15H18N2/c1-2-4-15-11-13(5-6-14(15)3-1)12-17-9-7-16-8-10-17/h1-6,11,16H,7-10,12H2
InChIKeyFDVCUOJHWRHXMF-UHFFFAOYSA-N
MW226.32 g/mol
LogP2.24
Rot. Bonds2

About 1-(naphthalen-2-ylmethyl)piperazine

1-(naphthalen-2-ylmethyl)piperazine (PubChem CID 910537) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-(naphthalen-2-ylmethyl)piperazine.

Molecular Properties

Compound Name1-(naphthalen-2-ylmethyl)piperazine
PubChem CID910537
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name1-(naphthalen-2-ylmethyl)piperazine
SMILESc1ccc2cc(CN3CCNCC3)ccc2c1
InChIInChI=1S/C15H18N2/c1-2-4-15-11-13(5-6-14(15)3-1)12-17-9-7-16-8-10-17/h1-6,11,16H,7-10,12H2
InChIKeyFDVCUOJHWRHXMF-UHFFFAOYSA-N
XLogP2.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Benzhydrylpiperazine
CID 70048
1-(1-Naphthylmethyl)piperazine
CID 701891
N-Methyl-N-naphthylmethylamine
CID 84474
5-ethyl-6-methyl-3-(2-naphthylmethylamino)-1H-pyridine-2-thione
CID 3000382
3-Methylbenzylpiperazine
CID 79213
Terbinafine(1+)
CID 1549007
9,10-Anthracenedimethanamine, N,N'-bis(2-(dimethylamino)ethyl)-
CID 60242
7-Methyl-1,2,3,4-tetrahydroisoquinoline
CID 13805378
1-(1,2-Diphenylethyl)piperazine
CID 12263801
1-(1-Phenyl-2-o-tolylethyl)piperazine
CID 44414708
1-(2-(2-Ethylphenyl)-1-phenylethyl)piperazine
CID 44414709
1-(1,3-Diphenylpropyl)piperazine
CID 44414840

Frequently Asked Questions

What is the IUPAC name of 1-(naphthalen-2-ylmethyl)piperazine?
The IUPAC name of 1-(naphthalen-2-ylmethyl)piperazine (CID 910537) is 1-(naphthalen-2-ylmethyl)piperazine.
What is the SMILES notation for 1-(naphthalen-2-ylmethyl)piperazine?
The canonical SMILES for 1-(naphthalen-2-ylmethyl)piperazine is c1ccc2cc(CN3CCNCC3)ccc2c1.
What is the InChIKey of 1-(naphthalen-2-ylmethyl)piperazine?
The InChIKey is FDVCUOJHWRHXMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-2-4-15-11-13(5-6-14(15)3-1)12-17-9-7-16-8-10-17/h1-6,11,16H,7-10,12H2.
What are the key properties of 1-(naphthalen-2-ylmethyl)piperazine?
1-(naphthalen-2-ylmethyl)piperazine has a molecular weight of 226.32 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(naphthalen-2-ylmethyl)piperazine is sourced from PubChem (CID 910537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).