1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride

C19H28Cl2N2 — CID 171307529

IUPAC1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride
SMILESCCCC[C@H](c1ccc2ccccc2c1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C19H26N2.2ClH/c1-2-3-8-19(21-13-11-20-12-14-21)18-10-9-16-6-4-5-7-17(16)15-18;;/h4-7,9-10,15,19-20H,2-3,8,11-14H2,1H3;2*1H/t19-;;/m1../s1
InChIKeyVZUSQQNPEIGNQW-JQDLGSOUSA-N
MW355.35 g/mol
LogP4.82
Rot. Bonds5

About 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride

1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride (PubChem CID 171307529) has the molecular formula C19H28Cl2N2 and a molecular weight of 355.35 g/mol. Its IUPAC name is 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride.

Molecular Properties

Compound Name1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride
PubChem CID171307529
Molecular FormulaC19H28Cl2N2
Molecular Weight355.35 g/mol
Exact Mass354.16
IUPAC Name1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride
SMILESCCCC[C@H](c1ccc2ccccc2c1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C19H26N2.2ClH/c1-2-3-8-19(21-13-11-20-12-14-21)18-10-9-16-6-4-5-7-17(16)15-18;;/h4-7,9-10,15,19-20H,2-3,8,11-14H2,1H3;2*1H/t19-;;/m1../s1
InChIKeyVZUSQQNPEIGNQW-JQDLGSOUSA-N
XLogP4.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.35
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride
CID 171287508
1-[(1R)-1-(6-methoxynaphthalen-2-yl)pentyl]piperazine
CID 171307368
1-[(1R)-4,4,4-trifluoro-1-naphthalen-2-ylbutyl]piperazine;hydrochloride
CID 171168796
6-[(1R)-1-piperazin-1-ylpentyl]-1H-indole;dihydrochloride
CID 171307830
1-[(1R)-1-(3-methoxyphenyl)pentyl]piperazine;dihydrochloride
CID 171307435
(2R)-2-naphthalen-2-yl-2-piperazin-1-ylethanol
CID 171183408
1-[(1S)-1-(3-chlorophenyl)pentyl]piperazine;dihydrochloride
CID 171308680
6-[(1S)-1-piperazin-1-ylbutyl]naphthalen-2-ol;dihydrochloride
CID 171275163
1-[(1R)-3,3-difluoro-1-naphthalen-2-ylpropyl]piperazine;hydrochloride
CID 171175433
1-[(1S)-1-(3,4-dimethoxyphenyl)pentyl]piperazine;dihydrochloride
CID 171308662
1-[(1S)-1-phenanthren-9-ylpentyl]piperazine;dihydrochloride
CID 171309540
1-[(1R)-1-[4-fluoro-3-(trifluoromethyl)phenyl]pentyl]piperazine;hydrochloride
CID 171169221

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride?
The IUPAC name of 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride (CID 171307529) is 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride.
What is the SMILES notation for 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride?
The canonical SMILES for 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride is CCCC[C@H](c1ccc2ccccc2c1)N1CCNCC1.Cl.Cl.
What is the InChIKey of 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride?
The InChIKey is VZUSQQNPEIGNQW-JQDLGSOUSA-N. The full InChI is InChI=1S/C19H26N2.2ClH/c1-2-3-8-19(21-13-11-20-12-14-21)18-10-9-16-6-4-5-7-17(16)15-18;;/h4-7,9-10,15,19-20H,2-3,8,11-14H2,1H3;2*1H/t19-;;/m1../s1.
What are the key properties of 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride?
1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride has a molecular weight of 355.35 g/mol, XLogP of 4.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride is sourced from PubChem (CID 171307529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).