(E)-N-ethoxy-1-naphthalen-2-ylethanimine

C14H15NO — CID 52540016

IUPAC(E)-N-ethoxy-1-naphthalen-2-ylethanimine
SMILESCCO/N=C(\C)c1ccc2ccccc2c1
InChIInChI=1S/C14H15NO/c1-3-16-15-11(2)13-9-8-12-6-4-5-7-14(12)10-13/h4-10H,3H2,1-2H3/b15-11+
InChIKeyBYOWDWQPAZXYNQ-RVDMUPIBSA-N
MW213.28 g/mol
LogP3.60
Rot. Bonds3

About (E)-N-ethoxy-1-naphthalen-2-ylethanimine

(E)-N-ethoxy-1-naphthalen-2-ylethanimine (PubChem CID 52540016) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is (E)-N-ethoxy-1-naphthalen-2-ylethanimine.

Molecular Properties

Compound Name(E)-N-ethoxy-1-naphthalen-2-ylethanimine
PubChem CID52540016
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name(E)-N-ethoxy-1-naphthalen-2-ylethanimine
SMILESCCO/N=C(\C)c1ccc2ccccc2c1
InChIInChI=1S/C14H15NO/c1-3-16-15-11(2)13-9-8-12-6-4-5-7-14(12)10-13/h4-10H,3H2,1-2H3/b15-11+
InChIKeyBYOWDWQPAZXYNQ-RVDMUPIBSA-N
XLogP3.60
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethylidene]hydroxylamine
CID 2747574
2-Naphthaldehyde oxime
CID 9563142
2,3-Dihydro-1H-phenanthren-4-one oxime
CID 9579790
(1E)-N-Hydroxy-1-(naphthalen-1-yl)ethanimine
CID 9569633
2,3-dihydro-1H-phenalen-1-one oxime
CID 5413766
(5R)-5-benzyl-3-naphthalen-2-yl-4,5-dihydro-1,2-oxazole
CID 71561576
(NZ)-N-(1-phenanthren-3-ylethylidene)hydroxylamine
CID 5354493
(5S)-5-benzyl-3-naphthalen-2-yl-4,5-dihydro-1,2-oxazole
CID 71561705
1-(Naphthalen-2-yl)ethanone oxime
CID 9561992
(NE)-N-(1-phenanthren-3-ylethylidene)hydroxylamine
CID 9561058
2-Acetylphenanthrene oxime
CID 9562560
2-[(E)-1-naphthalen-1-ylethylideneamino]oxyacetic acid
CID 12385379

Frequently Asked Questions

What is the IUPAC name of (E)-N-ethoxy-1-naphthalen-2-ylethanimine?
The IUPAC name of (E)-N-ethoxy-1-naphthalen-2-ylethanimine (CID 52540016) is (E)-N-ethoxy-1-naphthalen-2-ylethanimine.
What is the SMILES notation for (E)-N-ethoxy-1-naphthalen-2-ylethanimine?
The canonical SMILES for (E)-N-ethoxy-1-naphthalen-2-ylethanimine is CCO/N=C(\C)c1ccc2ccccc2c1.
What is the InChIKey of (E)-N-ethoxy-1-naphthalen-2-ylethanimine?
The InChIKey is BYOWDWQPAZXYNQ-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H15NO/c1-3-16-15-11(2)13-9-8-12-6-4-5-7-14(12)10-13/h4-10H,3H2,1-2H3/b15-11+.
What are the key properties of (E)-N-ethoxy-1-naphthalen-2-ylethanimine?
(E)-N-ethoxy-1-naphthalen-2-ylethanimine has a molecular weight of 213.28 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-ethoxy-1-naphthalen-2-ylethanimine is sourced from PubChem (CID 52540016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).