2-ethyl-N-[(Z)-propylideneamino]aniline

C11H16N2 — CID 144945326

IUPAC2-ethyl-N-[(Z)-propylideneamino]aniline
SMILESCC/C=N\Nc1ccccc1CC
InChIInChI=1S/C11H16N2/c1-3-9-12-13-11-8-6-5-7-10(11)4-2/h5-9,13H,3-4H2,1-2H3/b12-9-
InChIKeyILQDAMOSJYZEBY-XFXZXTDPSA-N
MW176.26 g/mol
LogP3.06
Rot. Bonds4

About 2-ethyl-N-[(Z)-propylideneamino]aniline

2-ethyl-N-[(Z)-propylideneamino]aniline (PubChem CID 144945326) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2-ethyl-N-[(Z)-propylideneamino]aniline.

Molecular Properties

Compound Name2-ethyl-N-[(Z)-propylideneamino]aniline
PubChem CID144945326
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name2-ethyl-N-[(Z)-propylideneamino]aniline
SMILESCC/C=N\Nc1ccccc1CC
InChIInChI=1S/C11H16N2/c1-3-9-12-13-11-8-6-5-7-10(11)4-2/h5-9,13H,3-4H2,1-2H3/b12-9-
InChIKeyILQDAMOSJYZEBY-XFXZXTDPSA-N
XLogP3.06
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 53.06
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'}

Analyze 2-ethyl-N-[(Z)-propylideneamino]aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-ethylphenyl)methanethioamide
CID 21063997
4-(2-ethylanilino)benzenethiol
CID 166755248
2-ethyl-N-[(2-ethylphenyl)methyl]aniline
CID 55197677
1-N,1-N'-bis(2-ethylphenyl)ethane-1,1-diamine
CID 129291272
4-N-(2-ethylphenyl)-1-N-methylbenzene-1,4-diamine
CID 117027221
1,2-diethylbenzene;propanal
CID 174478177
2-(2-ethylanilino)-2-oxoacetyl chloride
CID 87858291
1,3-bis(2-ethylphenyl)thiourea
CID 3034485
N,N'-bis(2-ethylphenyl)propanediamide
CID 3881876
N-(2-ethylphenyl)-N'-(2-phenylethylideneamino)oxamide
CID 4656715
2-ethyl-N-[(E)-1-thiophen-2-ylethylideneamino]aniline
CID 7340543
1,2-diethylbenzene;hydrobromide
CID 174973685

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(Z)-propylideneamino]aniline?
The IUPAC name of 2-ethyl-N-[(Z)-propylideneamino]aniline (CID 144945326) is 2-ethyl-N-[(Z)-propylideneamino]aniline.
What is the SMILES notation for 2-ethyl-N-[(Z)-propylideneamino]aniline?
The canonical SMILES for 2-ethyl-N-[(Z)-propylideneamino]aniline is CC/C=N\Nc1ccccc1CC.
What is the InChIKey of 2-ethyl-N-[(Z)-propylideneamino]aniline?
The InChIKey is ILQDAMOSJYZEBY-XFXZXTDPSA-N. The full InChI is InChI=1S/C11H16N2/c1-3-9-12-13-11-8-6-5-7-10(11)4-2/h5-9,13H,3-4H2,1-2H3/b12-9-.
What are the key properties of 2-ethyl-N-[(Z)-propylideneamino]aniline?
2-ethyl-N-[(Z)-propylideneamino]aniline has a molecular weight of 176.26 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(Z)-propylideneamino]aniline is sourced from PubChem (CID 144945326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).