N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine

C11H16N2O — CID 121219579

IUPACN-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine
SMILESCOC/C(=N/N(C)C)c1ccccc1
InChIInChI=1S/C11H16N2O/c1-13(2)12-11(9-14-3)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3/b12-11-
InChIKeyGFPDQVFKPXBLLG-QXMHVHEDSA-N
MW192.26 g/mol
LogP1.60
Rot. Bonds4

About N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine

N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine (PubChem CID 121219579) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine.

Molecular Properties

Compound NameN-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine
PubChem CID121219579
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine
SMILESCOC/C(=N/N(C)C)c1ccccc1
InChIInChI=1S/C11H16N2O/c1-13(2)12-11(9-14-3)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3/b12-11-
InChIKeyGFPDQVFKPXBLLG-QXMHVHEDSA-N
XLogP1.60
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.60
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

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CID 833073
2-methoxy-3-phenyl-2H-azirine
CID 14088933
2-Methoxy-1-phenylethan-1-imine
CID 17979406
2,2-Dimethyl-4-phenyl-3-oxazoline
CID 20517773
3-Methyl-5-(4-methylphenyl)-6-(trifluoromethyl)-3,6-dihydro-2H-1,3,4-oxadiazine
CID 365916
2-Butoxy-1-(2-fluorophenyl)ethanimine
CID 90253242
2-ethoxy-N-ethyl-1-(4-fluorophenyl)prop-2-en-1-imine
CID 149421803
N-ethyl-1-(4-fluorophenyl)-2-propoxyprop-2-en-1-imine
CID 163597565
1-(2-Fluorophenyl)-2-methoxyethanimine
CID 171532895
4-methoxy-5-phenyl-3,4-dihydro-2H-pyrrole
CID 12327451
(NZ)-N-(2-methoxy-1-phenylethylidene)hydroxylamine
CID 23278358
5-phenyl-3,6-dihydro-2H-1,4-oxazine
CID 86009484

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine?
The IUPAC name of N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine (CID 121219579) is N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine.
What is the SMILES notation for N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine?
The canonical SMILES for N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine is COC/C(=N/N(C)C)c1ccccc1.
What is the InChIKey of N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine?
The InChIKey is GFPDQVFKPXBLLG-QXMHVHEDSA-N. The full InChI is InChI=1S/C11H16N2O/c1-13(2)12-11(9-14-3)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3/b12-11-.
What are the key properties of N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine?
N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine has a molecular weight of 192.26 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-methoxy-1-phenylethylidene)amino]-N-methylmethanamine is sourced from PubChem (CID 121219579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).