N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine

C18H24N2 — CID 172941166

IUPACN-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine
SMILESCCc1cc(/C(C)=N/N(C)C)c2cc(CC)ccc2c1
InChIInChI=1S/C18H24N2/c1-6-14-8-9-16-10-15(7-2)12-17(18(16)11-14)13(3)19-20(4)5/h8-12H,6-7H2,1-5H3/b19-13+
InChIKeyOXICECQZIXMRCC-CPNJWEJPSA-N
MW268.40 g/mol
LogP4.25
Rot. Bonds4

About N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine

N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine (PubChem CID 172941166) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine.

Molecular Properties

Compound NameN-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine
PubChem CID172941166
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine
SMILESCCc1cc(/C(C)=N/N(C)C)c2cc(CC)ccc2c1
InChIInChI=1S/C18H24N2/c1-6-14-8-9-16-10-15(7-2)12-17(18(16)11-14)13(3)19-20(4)5/h8-12H,6-7H2,1-5H3/b19-13+
InChIKeyOXICECQZIXMRCC-CPNJWEJPSA-N
XLogP4.25
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.25
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

2-(1-Phenanthren-3-ylethylideneamino)guanidine;hydrochloride
CID 44531570
2-(1-Phenanthren-2-ylethylideneamino)guanidine;hydrochloride
CID 44531574
Hydrazinium, 2-(alpha,3,4-trimethylbenzylidene)-1,1,1-trimethyl-, iodide
CID 5459342
N-[(2,6-dimethylphenyl)(phenyl)methylene]-N-methylamine
CID 1203670
Diphenylmethanone dimethylhydrazone
CID 290922
1-(Naphthalen-2-yl)ethanone oxime
CID 9561992
N-[(E)-[10-[(E)-(dimethylhydrazinylidene)methyl]anthracen-9-yl]methylideneamino]-N-methylmethanamine
CID 44365678
(1-Naphthalen-2-YL-ethylidene)-hydrazine
CID 9615558
(E)-1-Naphthalen-2-yl-N-[(E)-1-naphthalen-2-ylethylideneamino]ethanimine
CID 9582864
Ethanone, 1-(2-naphthalenyl)-, oxime, (Z)-
CID 5358481
1-(2-Naphthalenyl)ethanone oxime
CID 318566
1-Naphthalen-1-yl-ethylideneamine
CID 597838

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine?
The IUPAC name of N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine (CID 172941166) is N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine.
What is the SMILES notation for N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine?
The canonical SMILES for N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine is CCc1cc(/C(C)=N/N(C)C)c2cc(CC)ccc2c1.
What is the InChIKey of N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine?
The InChIKey is OXICECQZIXMRCC-CPNJWEJPSA-N. The full InChI is InChI=1S/C18H24N2/c1-6-14-8-9-16-10-15(7-2)12-17(18(16)11-14)13(3)19-20(4)5/h8-12H,6-7H2,1-5H3/b19-13+.
What are the key properties of N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine?
N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine has a molecular weight of 268.40 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]-N-methylmethanamine is sourced from PubChem (CID 172941166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).