2,4-dimethyl-N-(propylideneamino)aniline

C11H16N2 — CID 174397032

IUPAC2,4-dimethyl-N-(propylideneamino)aniline
SMILESCCC=NNc1ccc(C)cc1C
InChIInChI=1S/C11H16N2/c1-4-7-12-13-11-6-5-9(2)8-10(11)3/h5-8,13H,4H2,1-3H3
InChIKeyUNMFQZVMPVKANU-UHFFFAOYSA-N
MW176.26 g/mol
LogP3.11
Rot. Bonds3

About 2,4-dimethyl-N-(propylideneamino)aniline

2,4-dimethyl-N-(propylideneamino)aniline (PubChem CID 174397032) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2,4-dimethyl-N-(propylideneamino)aniline.

Molecular Properties

Compound Name2,4-dimethyl-N-(propylideneamino)aniline
PubChem CID174397032
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name2,4-dimethyl-N-(propylideneamino)aniline
SMILESCCC=NNc1ccc(C)cc1C
InChIInChI=1S/C11H16N2/c1-4-7-12-13-11-6-5-9(2)8-10(11)3/h5-8,13H,4H2,1-3H3
InChIKeyUNMFQZVMPVKANU-UHFFFAOYSA-N
XLogP3.11
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 53.11
H-Bond Donors ≤ 51
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

N-[(E)-(4-amino-4-methylpentylidene)amino]-2,4-dimethylaniline
CID 20683650
2-ethyl-N-[(Z)-propylideneamino]aniline
CID 144945326
4-[[(2,4-dimethylphenyl)hydrazinylidene]methyl]-2,6-dimethoxyphenol
CID 4521034
N,2,4-trimethylaniline;hydrochloride
CID 18686602
2,4-dimethyl-N-prop-2-enylaniline
CID 11768869
N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-2,4-dimethylaniline
CID 124560954
2,4-dimethyl-N-(3-methylbut-2-enyl)aniline
CID 103604357
N-[(E)-[1-(3,4-dimethylphenyl)-3,5-dimethylpyrazol-4-yl]methylideneamino]-2,4-dimethylaniline
CID 126001450
1-(2,4-dimethylanilino)-2-methylbutan-2-ol
CID 114492467
N-[(2,4-dimethylphenyl)carbamothioyl]propanamide
CID 3777928
N,N'-bis(2,4-dimethylphenyl)oxamide
CID 3416969
N-butyl-N'-(2,4-dimethylphenyl)ethane-1,2-diamine
CID 54805874

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(propylideneamino)aniline?
The IUPAC name of 2,4-dimethyl-N-(propylideneamino)aniline (CID 174397032) is 2,4-dimethyl-N-(propylideneamino)aniline.
What is the SMILES notation for 2,4-dimethyl-N-(propylideneamino)aniline?
The canonical SMILES for 2,4-dimethyl-N-(propylideneamino)aniline is CCC=NNc1ccc(C)cc1C.
What is the InChIKey of 2,4-dimethyl-N-(propylideneamino)aniline?
The InChIKey is UNMFQZVMPVKANU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-4-7-12-13-11-6-5-9(2)8-10(11)3/h5-8,13H,4H2,1-3H3.
What are the key properties of 2,4-dimethyl-N-(propylideneamino)aniline?
2,4-dimethyl-N-(propylideneamino)aniline has a molecular weight of 176.26 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(propylideneamino)aniline is sourced from PubChem (CID 174397032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).