1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine

C16H20N2O2 — CID 65364701

IUPAC1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine
SMILESCOCOc1ccc2ccccc2c1N1CCNCC1
InChIInChI=1S/C16H20N2O2/c1-19-12-20-15-7-6-13-4-2-3-5-14(13)16(15)18-10-8-17-9-11-18/h2-7,17H,8-12H2,1H3
InChIKeyFZLNSXZWVGDVFR-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.23
Rot. Bonds4

About 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine

1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine (PubChem CID 65364701) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine.

Molecular Properties

Compound Name1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine
PubChem CID65364701
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine
SMILESCOCOc1ccc2ccccc2c1N1CCNCC1
InChIInChI=1S/C16H20N2O2/c1-19-12-20-15-7-6-13-4-2-3-5-14(13)16(15)18-10-8-17-9-11-18/h2-7,17H,8-12H2,1H3
InChIKeyFZLNSXZWVGDVFR-UHFFFAOYSA-N
XLogP2.23
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine?
The IUPAC name of 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine (CID 65364701) is 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine.
What is the SMILES notation for 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine?
The canonical SMILES for 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine is COCOc1ccc2ccccc2c1N1CCNCC1.
What is the InChIKey of 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine?
The InChIKey is FZLNSXZWVGDVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-19-12-20-15-7-6-13-4-2-3-5-14(13)16(15)18-10-8-17-9-11-18/h2-7,17H,8-12H2,1H3.
What are the key properties of 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine?
1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine has a molecular weight of 272.35 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(methoxymethoxy)naphthalen-1-yl]piperazine is sourced from PubChem (CID 65364701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).