1-(2-naphthalen-1-ylpropyl)piperazine

C17H22N2 — CID 116964774

IUPAC1-(2-naphthalen-1-ylpropyl)piperazine
SMILESCC(CN1CCNCC1)c1cccc2ccccc12
InChIInChI=1S/C17H22N2/c1-14(13-19-11-9-18-10-12-19)16-8-4-6-15-5-2-3-7-17(15)16/h2-8,14,18H,9-13H2,1H3
InChIKeyQYMGXZNSZLELBY-UHFFFAOYSA-N
MW254.38 g/mol
LogP2.85
Rot. Bonds3

About 1-(2-naphthalen-1-ylpropyl)piperazine

1-(2-naphthalen-1-ylpropyl)piperazine (PubChem CID 116964774) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 1-(2-naphthalen-1-ylpropyl)piperazine.

Molecular Properties

Compound Name1-(2-naphthalen-1-ylpropyl)piperazine
PubChem CID116964774
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name1-(2-naphthalen-1-ylpropyl)piperazine
SMILESCC(CN1CCNCC1)c1cccc2ccccc12
InChIInChI=1S/C17H22N2/c1-14(13-19-11-9-18-10-12-19)16-8-4-6-15-5-2-3-7-17(15)16/h2-8,14,18H,9-13H2,1H3
InChIKeyQYMGXZNSZLELBY-UHFFFAOYSA-N
XLogP2.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-piperazin-1-ylpropan-2-yl)phenol
CID 83837907
1-[2-(2-methylphenyl)propyl]piperazine
CID 82509211
4-(1-piperazin-1-ylpropan-2-yl)quinoline
CID 116985454
2-methyl-1-naphthalen-1-yl-3-piperazin-1-ylpropan-1-one
CID 82262999
1-[2-(2-methoxyphenyl)propyl]-1,4-diazepane
CID 82086944
1-(1-naphthalen-1-yl-2-piperazin-1-ylethyl)cyclobutan-1-ol;dihydrochloride
CID 68855773
1-[(1R)-3-methyl-1-naphthalen-1-ylbutyl]piperazine;dihydrochloride
CID 171294063
naphthalen-1-yl-[2-(piperazin-1-ylmethyl)phenyl]methanethiol
CID 22744873
1-[2-(4-methylpiperazin-1-yl)-1-naphthalen-1-ylethyl]cyclooctan-1-ol;1-(1-naphthalen-1-yl-2-piperazin-1-ylethyl)cycloheptan-1-ol
CID 158483163
4-tert-butyl-1-(1-naphthalen-1-yl-2-piperazin-1-ylethyl)cyclohexan-1-ol
CID 11153627
(2S)-2-naphthalen-1-yl-2-piperazin-1-ylethanol
CID 171183143
1-[2-(3-methylphenyl)propyl]piperazine
CID 82509212

Frequently Asked Questions

What is the IUPAC name of 1-(2-naphthalen-1-ylpropyl)piperazine?
The IUPAC name of 1-(2-naphthalen-1-ylpropyl)piperazine (CID 116964774) is 1-(2-naphthalen-1-ylpropyl)piperazine.
What is the SMILES notation for 1-(2-naphthalen-1-ylpropyl)piperazine?
The canonical SMILES for 1-(2-naphthalen-1-ylpropyl)piperazine is CC(CN1CCNCC1)c1cccc2ccccc12.
What is the InChIKey of 1-(2-naphthalen-1-ylpropyl)piperazine?
The InChIKey is QYMGXZNSZLELBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-14(13-19-11-9-18-10-12-19)16-8-4-6-15-5-2-3-7-17(15)16/h2-8,14,18H,9-13H2,1H3.
What are the key properties of 1-(2-naphthalen-1-ylpropyl)piperazine?
1-(2-naphthalen-1-ylpropyl)piperazine has a molecular weight of 254.38 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-naphthalen-1-ylpropyl)piperazine is sourced from PubChem (CID 116964774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).