[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine

C23H21NO2 — CID 20985427

IUPAC[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine
SMILESNCc1c(OCCOc2ccc3ccccc3c2)ccc2ccccc12
InChIInChI=1S/C23H21NO2/c24-16-22-21-8-4-3-6-18(21)10-12-23(22)26-14-13-25-20-11-9-17-5-1-2-7-19(17)15-20/h1-12,15H,13-14,16,24H2
InChIKeyFJTAVFGXIYHQPP-UHFFFAOYSA-N
MW343.43 g/mol
LogP4.91
Rot. Bonds6

About [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine

[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine (PubChem CID 20985427) has the molecular formula C23H21NO2 and a molecular weight of 343.43 g/mol. Its IUPAC name is [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine.

Molecular Properties

Compound Name[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine
PubChem CID20985427
Molecular FormulaC23H21NO2
Molecular Weight343.43 g/mol
Exact Mass343.16
IUPAC Name[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine
SMILESNCc1c(OCCOc2ccc3ccccc3c2)ccc2ccccc12
InChIInChI=1S/C23H21NO2/c24-16-22-21-8-4-3-6-18(21)10-12-23(22)26-14-13-25-20-11-9-17-5-1-2-7-19(17)15-20/h1-12,15H,13-14,16,24H2
InChIKeyFJTAVFGXIYHQPP-UHFFFAOYSA-N
XLogP4.91
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

[2-[2-(2,3,5-trimethylphenoxy)ethoxy]naphthalen-1-yl]methanamine
CID 20984389
[4-(2-naphthalen-2-yloxyethoxy)phenyl]methanamine
CID 20990903
[5-chloro-2-(2-naphthalen-2-yloxyethoxy)phenyl]methanamine
CID 22687111
3-[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]prop-2-enoic acid
CID 20993650
[2-(ethoxymethoxy)naphthalen-1-yl]methanamine
CID 65369670
1-[1-(aminomethyl)naphthalen-2-yl]oxypropan-2-ol
CID 60888861
2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]naphthalen-1-yl]ethanamine
CID 115943256
[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine
CID 43505452
3-(2-butoxynaphthalen-1-yl)propan-1-amine
CID 170867884
3-[2-[2-(4-chloro-3-methylphenoxy)ethoxy]naphthalen-1-yl]propanoic acid
CID 22685443
2-[4-methoxy-2-(2-naphthalen-2-yloxyethoxy)phenyl]ethanamine
CID 20984431
5-naphthalen-1-yloxypentanoic acid;5-naphthalen-2-yloxypentanoic acid
CID 138543521

Frequently Asked Questions

What is the IUPAC name of [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine?
The IUPAC name of [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine (CID 20985427) is [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine.
What is the SMILES notation for [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine?
The canonical SMILES for [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine is NCc1c(OCCOc2ccc3ccccc3c2)ccc2ccccc12.
What is the InChIKey of [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine?
The InChIKey is FJTAVFGXIYHQPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO2/c24-16-22-21-8-4-3-6-18(21)10-12-23(22)26-14-13-25-20-11-9-17-5-1-2-7-19(17)15-20/h1-12,15H,13-14,16,24H2.
What are the key properties of [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine?
[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine has a molecular weight of 343.43 g/mol, XLogP of 4.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine is sourced from PubChem (CID 20985427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).