4-methoxy-2-(methylideneamino)aniline

C8H10N2O — CID 163228388

IUPAC4-methoxy-2-(methylideneamino)aniline
SMILESC=Nc1cc(OC)ccc1N
InChIInChI=1S/C8H10N2O/c1-10-8-5-6(11-2)3-4-7(8)9/h3-5H,1,9H2,2H3
InChIKeyNRUGXEGVDIKXNN-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.61
Rot. Bonds2

About 4-methoxy-2-(methylideneamino)aniline

4-methoxy-2-(methylideneamino)aniline (PubChem CID 163228388) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 4-methoxy-2-(methylideneamino)aniline.

Molecular Properties

Compound Name4-methoxy-2-(methylideneamino)aniline
PubChem CID163228388
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name4-methoxy-2-(methylideneamino)aniline
SMILESC=Nc1cc(OC)ccc1N
InChIInChI=1S/C8H10N2O/c1-10-8-5-6(11-2)3-4-7(8)9/h3-5H,1,9H2,2H3
InChIKeyNRUGXEGVDIKXNN-UHFFFAOYSA-N
XLogP1.61
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

5-methoxy-N-methyl-2-(methylideneamino)aniline
CID 143659024
2-fluoro-4-methoxyaniline
CID 3756383
N-(4-methoxy-2-prop-1-en-2-ylphenyl)methanimine
CID 145260845
2-dimethylphosphanyl-4-methoxyaniline
CID 164564121
4-[1-[4-methoxy-2-(methylideneamino)phenyl]ethenoxy]benzenethiol
CID 168886662
4-methoxy-2-(trifluoromethyl)aniline
CID 22601721
2-(difluoromethyl)-4-methoxyaniline
CID 45091134
2-iodo-5-methoxyaniline
CID 11139508
2-amino-5-methoxybenzoic acid;hydrochloride
CID 15618229
2-(1-iodoethyl)-5-methoxyaniline
CID 170370937
4-methoxy-2-trimethylsilyloxyaniline
CID 167737964
2,5-dimethoxyaniline;molecular hydrogen
CID 159599481

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(methylideneamino)aniline?
The IUPAC name of 4-methoxy-2-(methylideneamino)aniline (CID 163228388) is 4-methoxy-2-(methylideneamino)aniline.
What is the SMILES notation for 4-methoxy-2-(methylideneamino)aniline?
The canonical SMILES for 4-methoxy-2-(methylideneamino)aniline is C=Nc1cc(OC)ccc1N.
What is the InChIKey of 4-methoxy-2-(methylideneamino)aniline?
The InChIKey is NRUGXEGVDIKXNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-10-8-5-6(11-2)3-4-7(8)9/h3-5H,1,9H2,2H3.
What are the key properties of 4-methoxy-2-(methylideneamino)aniline?
4-methoxy-2-(methylideneamino)aniline has a molecular weight of 150.18 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(methylideneamino)aniline is sourced from PubChem (CID 163228388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).