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

C17H24Cl2N2 — CID 171287508

IUPAC1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride
SMILESCC[C@H](c1ccc2ccccc2c1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C17H22N2.2ClH/c1-2-17(19-11-9-18-10-12-19)16-8-7-14-5-3-4-6-15(14)13-16;;/h3-8,13,17-18H,2,9-12H2,1H3;2*1H/t17-;;/m1../s1
InChIKeyKONQDIFSJLDIHD-ZEECNFPPSA-N
MW327.30 g/mol
LogP4.04
Rot. Bonds3

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

1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride (PubChem CID 171287508) has the molecular formula C17H24Cl2N2 and a molecular weight of 327.30 g/mol. Its IUPAC name is 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride.

Molecular Properties

Compound Name1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride
PubChem CID171287508
Molecular FormulaC17H24Cl2N2
Molecular Weight327.30 g/mol
Exact Mass326.13
IUPAC Name1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride
SMILESCC[C@H](c1ccc2ccccc2c1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C17H22N2.2ClH/c1-2-17(19-11-9-18-10-12-19)16-8-7-14-5-3-4-6-15(14)13-16;;/h3-8,13,17-18H,2,9-12H2,1H3;2*1H/t17-;;/m1../s1
InChIKeyKONQDIFSJLDIHD-ZEECNFPPSA-N
XLogP4.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.30
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1R)-1-naphthalen-2-ylpentyl]piperazine;dihydrochloride
CID 171307529
(2R)-2-naphthalen-2-yl-2-piperazin-1-ylethanol
CID 171183408
1-[(1R)-3,3-difluoro-1-naphthalen-2-ylpropyl]piperazine;hydrochloride
CID 171175433
1-[(1R)-4,4,4-trifluoro-1-naphthalen-2-ylbutyl]piperazine;hydrochloride
CID 171168796
1-[(1R)-1-phenylpropyl]piperazine;dihydrochloride
CID 171295514
1-[(1R)-2-methyl-1-naphthalen-2-ylbutyl]piperazine
CID 171304370
1-[(1R)-1-naphthalen-2-ylethyl]piperazine
CID 93464443
4-[(1R)-1-piperazin-1-ylpropyl]benzene-1,2-diol;dihydrochloride
CID 171285097
1-[(1S)-1-(3,4-difluorophenyl)propyl]piperazine;dihydrochloride
CID 171280439
1-[1-(4-methoxyphenyl)propyl]piperazine
CID 3971378
1-[(1R)-1-(4-methylphenyl)propyl]piperazine;dihydrochloride
CID 171294154
3-(1-piperazin-1-ylpropyl)phenol;dihydrochloride
CID 23080544

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride?
The IUPAC name of 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride (CID 171287508) is 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride.
What is the SMILES notation for 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride?
The canonical SMILES for 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride is CC[C@H](c1ccc2ccccc2c1)N1CCNCC1.Cl.Cl.
What is the InChIKey of 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride?
The InChIKey is KONQDIFSJLDIHD-ZEECNFPPSA-N. The full InChI is InChI=1S/C17H22N2.2ClH/c1-2-17(19-11-9-18-10-12-19)16-8-7-14-5-3-4-6-15(14)13-16;;/h3-8,13,17-18H,2,9-12H2,1H3;2*1H/t17-;;/m1../s1.
What are the key properties of 1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride?
1-[(1R)-1-naphthalen-2-ylpropyl]piperazine;dihydrochloride has a molecular weight of 327.30 g/mol, XLogP of 4.04, 3 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-ylpropyl]piperazine;dihydrochloride is sourced from PubChem (CID 171287508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).