1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine

C19H23NO3 — CID 140553282

IUPAC1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
SMILESCC(=NOCCOC1CCCCO1)c1ccc2ccccc2c1
InChIInChI=1S/C19H23NO3/c1-15(17-10-9-16-6-2-3-7-18(16)14-17)20-23-13-12-22-19-8-4-5-11-21-19/h2-3,6-7,9-10,14,19H,4-5,8,11-13H2,1H3
InChIKeyRHSWLRKIJQCFQB-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.12
Rot. Bonds6

About 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine

1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine (PubChem CID 140553282) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine.

Molecular Properties

Compound Name1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
PubChem CID140553282
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
SMILESCC(=NOCCOC1CCCCO1)c1ccc2ccccc2c1
InChIInChI=1S/C19H23NO3/c1-15(17-10-9-16-6-2-3-7-18(16)14-17)20-23-13-12-22-19-8-4-5-11-21-19/h2-3,6-7,9-10,14,19H,4-5,8,11-13H2,1H3
InChIKeyRHSWLRKIJQCFQB-UHFFFAOYSA-N
XLogP4.12
TPSA40.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(5R,6R,7S,8R,9R)-6,7,8-triacetyloxy-3-naphthalen-2-yl-1,10-dioxa-2-azaspiro[4.5]dec-2-en-9-yl]methyl acetate
CID 127026839
(E)-N-(1,3-dioxan-2-ylmethoxy)-2,2,2-trifluoro-1-[3-(trifluoromethyl)naphthalen-1-yl]ethanimine
CID 18598750
N-(1,3-dioxan-2-ylmethoxy)-2,2,2-trifluoro-1-[3-(trifluoromethyl)naphthalen-1-yl]ethanimine
CID 56620976
N-[1-[4-(4-fluorophenyl)-2-[2-(oxan-2-yloxy)ethyl]phenyl]ethylidene]hydroxylamine
CID 88277041
N-[1-[2-[2-(oxan-2-yloxy)ethyl]-4-[4-(trifluoromethyl)phenyl]phenyl]ethylidene]hydroxylamine
CID 88277480
(4R,6R)-4-bromo-6-ethoxy-3-naphthalen-2-yl-5,6-dihydro-4H-oxazine
CID 102377636
(4S,6R)-4-bromo-6-ethoxy-3-naphthalen-2-yl-5,6-dihydro-4H-oxazine
CID 134936224
(E)-1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]methanimine
CID 87476788
(E)-1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
CID 87478802
Methyl 2-methyl-5-[4-(1-naphthalen-2-ylethylideneamino)oxybutyl]-1,3-dioxane-2-carboxylate
CID 87570659
Methyl 2-methyl-5-[5-(1-naphthalen-2-ylethylideneamino)oxypentyl]-1,3-dioxane-2-carboxylate
CID 87571608
2-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine
CID 87589119

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
The IUPAC name of 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine (CID 140553282) is 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine.
What is the SMILES notation for 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
The canonical SMILES for 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine is CC(=NOCCOC1CCCCO1)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
The InChIKey is RHSWLRKIJQCFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-15(17-10-9-16-6-2-3-7-18(16)14-17)20-23-13-12-22-19-8-4-5-11-21-19/h2-3,6-7,9-10,14,19H,4-5,8,11-13H2,1H3.
What are the key properties of 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine?
1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine has a molecular weight of 313.40 g/mol, XLogP of 4.12, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-N-[2-(oxan-2-yloxy)ethoxy]ethanimine is sourced from PubChem (CID 140553282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).