2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol

C16H20N2O — CID 143054904

IUPAC2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol
SMILESCCN(CCO)/N=C(\C)c1cccc2ccccc12
InChIInChI=1S/C16H20N2O/c1-3-18(11-12-19)17-13(2)15-10-6-8-14-7-4-5-9-16(14)15/h4-10,19H,3,11-12H2,1-2H3/b17-13+
InChIKeyUIELULGCZHDPGK-GHRIWEEISA-N
MW256.35 g/mol
LogP2.88
Rot. Bonds5

About 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol

2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol (PubChem CID 143054904) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol
PubChem CID143054904
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol
SMILESCCN(CCO)/N=C(\C)c1cccc2ccccc12
InChIInChI=1S/C16H20N2O/c1-3-18(11-12-19)17-13(2)15-10-6-8-14-7-4-5-9-16(14)15/h4-10,19H,3,11-12H2,1-2H3/b17-13+
InChIKeyUIELULGCZHDPGK-GHRIWEEISA-N
XLogP2.88
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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,N-diethyl-2-[(Z)-naphthalen-1-ylmethylideneamino]oxyethanamine
CID 6434663
(2R)-1-methoxy-N-[(E)-1-naphthalen-2-ylethylideneamino]-N-(2,2,2-trifluoroethyl)butan-2-amine
CID 177622336
N-morpholin-4-yl-1-naphthalen-1-ylmethanimine
CID 5160191
1-[3-[1-(2,5-Dimethylphenyl)butan-2-yl]-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]ethanol
CID 143656556
N-[(E)-1-(3,7-diethylnaphthalen-2-yl)ethylideneamino]-N-methylmethanamine
CID 172922752
N-[(E)-1-(1,5-diethylnaphthalen-2-yl)ethylideneamino]-N-methylmethanamine
CID 172922754
N-[(E)-1-(1,4-diethylnaphthalen-2-yl)ethylideneamino]-N-methylmethanamine
CID 172928172
N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine
CID 172941166
N-[(E)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]-N-methylmethanamine
CID 172941167
N-[1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]-N-methylmethanamine
CID 175624152
(Z)-N-morpholin-4-yl-1-naphthalen-1-ylmethanimine
CID 6287484
N,N-diethyl-2-[(E)-naphthalen-1-ylmethylideneamino]oxyethanamine
CID 6857941

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol?
The IUPAC name of 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol (CID 143054904) is 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol.
What is the SMILES notation for 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol?
The canonical SMILES for 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol is CCN(CCO)/N=C(\C)c1cccc2ccccc12.
What is the InChIKey of 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol?
The InChIKey is UIELULGCZHDPGK-GHRIWEEISA-N. The full InChI is InChI=1S/C16H20N2O/c1-3-18(11-12-19)17-13(2)15-10-6-8-14-7-4-5-9-16(14)15/h4-10,19H,3,11-12H2,1-2H3/b17-13+.
What are the key properties of 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol?
2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol has a molecular weight of 256.35 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[(E)-1-naphthalen-1-ylethylideneamino]amino]ethanol is sourced from PubChem (CID 143054904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).