N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine

C15H18N2O — CID 110338371

IUPACN-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine
SMILESCCOc1ccc2ccccc2c1/C=N/N(C)C
InChIInChI=1S/C15H18N2O/c1-4-18-15-10-9-12-7-5-6-8-13(12)14(15)11-16-17(2)3/h5-11H,4H2,1-3H3/b16-11+
InChIKeyXKYICAKZJPBCEC-LFIBNONCSA-N
MW242.32 g/mol
LogP3.13
Rot. Bonds4

About N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine

N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine (PubChem CID 110338371) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine.

Molecular Properties

Compound NameN-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine
PubChem CID110338371
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine
SMILESCCOc1ccc2ccccc2c1/C=N/N(C)C
InChIInChI=1S/C15H18N2O/c1-4-18-15-10-9-12-7-5-6-8-13(12)14(15)11-16-17(2)3/h5-11H,4H2,1-3H3/b16-11+
InChIKeyXKYICAKZJPBCEC-LFIBNONCSA-N
XLogP3.13
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.13
H-Bond Donors ≤ 50
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

(Z)-1-(2-ethoxynaphthalen-1-yl)-N-(1,2,4-triazol-4-yl)methanimine
CID 7638517
2-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]guanidine
CID 71670095
1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine
CID 3549672
4-[(2-ethoxynaphthalen-1-yl)methylideneamino]benzenesulfonamide
CID 3940132
3-(2-ethoxynaphthalen-1-yl)-N-methylprop-2-en-1-amine
CID 169474689
2-[(E)-2-(2-ethoxynaphthalen-1-yl)ethenyl]quinoline
CID 7945989
4-ethoxy-N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]benzenesulfonamide
CID 110516688
1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine
CID 139088664
N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 5334451
1-[(2-ethoxynaphthalen-1-yl)methylideneamino]-3-(2-methylphenyl)urea
CID 926829
3-[(2-ethoxynaphthalen-1-yl)methylideneamino]-1H-quinazoline-2,4-dione
CID 3293662
(2S)-N-[(2-ethoxynaphthalen-1-yl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 871144

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine?
The IUPAC name of N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine (CID 110338371) is N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine.
What is the SMILES notation for N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine?
The canonical SMILES for N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine is CCOc1ccc2ccccc2c1/C=N/N(C)C.
What is the InChIKey of N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine?
The InChIKey is XKYICAKZJPBCEC-LFIBNONCSA-N. The full InChI is InChI=1S/C15H18N2O/c1-4-18-15-10-9-12-7-5-6-8-13(12)14(15)11-16-17(2)3/h5-11H,4H2,1-3H3/b16-11+.
What are the key properties of N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine?
N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine has a molecular weight of 242.32 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine is sourced from PubChem (CID 110338371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).