1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine

C17H22N2O — CID 171286074

IUPAC1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine
SMILESCOc1ccc2cc([C@@H](C)N3CCNCC3)ccc2c1
InChIInChI=1S/C17H22N2O/c1-13(19-9-7-18-8-10-19)14-3-4-16-12-17(20-2)6-5-15(16)11-14/h3-6,11-13,18H,7-10H2,1-2H3/t13-/m1/s1
InChIKeyYBBGLXOTCLDLLD-CYBMUJFWSA-N
MW270.38 g/mol
LogP2.81
Rot. Bonds3

About 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine

1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine (PubChem CID 171286074) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine
PubChem CID171286074
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine
SMILESCOc1ccc2cc([C@@H](C)N3CCNCC3)ccc2c1
InChIInChI=1S/C17H22N2O/c1-13(19-9-7-18-8-10-19)14-3-4-16-12-17(20-2)6-5-15(16)11-14/h3-6,11-13,18H,7-10H2,1-2H3/t13-/m1/s1
InChIKeyYBBGLXOTCLDLLD-CYBMUJFWSA-N
XLogP2.81
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1R)-1-(4-methoxyphenyl)ethyl]piperazine
CID 7047764
1-[(1R)-1-naphthalen-2-ylethyl]piperazine
CID 93464443
1-[(1R)-1-(6-methoxynaphthalen-2-yl)-4-methylpentyl]piperazine
CID 171310667
1-[1-(6-methoxynaphthalen-2-yl)ethyl]piperidin-4-amine
CID 43130766
1-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]piperazine
CID 28798624
(3S)-3-(6-methoxynaphthalen-2-yl)-3-piperazin-1-ylpropan-1-ol
CID 171189440
1-(1-naphthalen-2-ylethyl)-1,4-diazepane
CID 61058086
(3R)-3-(6-methoxynaphthalen-2-yl)-3-piperazin-1-ylpropanenitrile
CID 171306560
1-[(1R)-1-(6-methoxynaphthalen-2-yl)pentyl]piperazine
CID 171307368
1-[(1R)-4,4,4-trifluoro-1-(6-methoxynaphthalen-2-yl)butyl]piperazine;hydrochloride
CID 171168427
1-[1-(6-methoxynaphthalen-2-yl)ethyl]azetidin-3-amine
CID 65244855
1-[(4-methoxyphenyl)-(4-propan-2-ylphenyl)methyl]piperazine
CID 3987731

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine?
The IUPAC name of 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine (CID 171286074) is 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine.
What is the SMILES notation for 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine?
The canonical SMILES for 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine is COc1ccc2cc([C@@H](C)N3CCNCC3)ccc2c1.
What is the InChIKey of 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine?
The InChIKey is YBBGLXOTCLDLLD-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H22N2O/c1-13(19-9-7-18-8-10-19)14-3-4-16-12-17(20-2)6-5-15(16)11-14/h3-6,11-13,18H,7-10H2,1-2H3/t13-/m1/s1.
What are the key properties of 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine?
1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine has a molecular weight of 270.38 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(6-methoxynaphthalen-2-yl)ethyl]piperazine is sourced from PubChem (CID 171286074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).