1-(4-ethylphenyl)-N-propylethanimine

C13H19N — CID 146572817

IUPAC1-(4-ethylphenyl)-N-propylethanimine
SMILESCCC/N=C(\C)c1ccc(CC)cc1
InChIInChI=1S/C13H19N/c1-4-10-14-11(3)13-8-6-12(5-2)7-9-13/h6-9H,4-5,10H2,1-3H3/b14-11+
InChIKeyOAMHNIYFYDLZAE-SDNWHVSQSA-N
MW189.30 g/mol
LogP3.47
Rot. Bonds4

About 1-(4-ethylphenyl)-N-propylethanimine

1-(4-ethylphenyl)-N-propylethanimine (PubChem CID 146572817) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-N-propylethanimine.

Molecular Properties

Compound Name1-(4-ethylphenyl)-N-propylethanimine
PubChem CID146572817
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name1-(4-ethylphenyl)-N-propylethanimine
SMILESCCC/N=C(\C)c1ccc(CC)cc1
InChIInChI=1S/C13H19N/c1-4-10-14-11(3)13-8-6-12(5-2)7-9-13/h6-9H,4-5,10H2,1-3H3/b14-11+
InChIKeyOAMHNIYFYDLZAE-SDNWHVSQSA-N
XLogP3.47
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[1-(4-ethylphenyl)ethylideneamino]thiourea
CID 3004060
1-[(E)-but-2-en-2-yl]-4-ethylbenzene
CID 19784779
N-(2-methoxyethyl)-1-(4-methylphenyl)ethanimine
CID 121015502
N-(4-butoxyphenyl)-1-(4-ethylphenyl)ethanimine
CID 91741362
N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-ethyl-N-(4-ethylphenyl)aniline
CID 59476621
N-[(E)-3-(4-ethylphenyl)but-2-en-2-yl]methanimine
CID 149002722
1-ethyl-4-(4-methylpenta-1,3-dien-3-yl)benzene
CID 143743129
1-(4-ethylphenyl)ethanone;formaldehyde
CID 143666715
N,N'-bis[1-(4-ethylphenyl)ethylideneamino]hexanediamide
CID 3720428
4-[1-(4-ethylphenyl)ethylideneamino]thiophen-3-amine
CID 118861434
ethane;ethylbenzene;methane;prop-1-ene;N-propylpropan-2-imine
CID 142074696
1,4-diethylbenzene;ethane
CID 91207141

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-N-propylethanimine?
The IUPAC name of 1-(4-ethylphenyl)-N-propylethanimine (CID 146572817) is 1-(4-ethylphenyl)-N-propylethanimine.
What is the SMILES notation for 1-(4-ethylphenyl)-N-propylethanimine?
The canonical SMILES for 1-(4-ethylphenyl)-N-propylethanimine is CCC/N=C(\C)c1ccc(CC)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-N-propylethanimine?
The InChIKey is OAMHNIYFYDLZAE-SDNWHVSQSA-N. The full InChI is InChI=1S/C13H19N/c1-4-10-14-11(3)13-8-6-12(5-2)7-9-13/h6-9H,4-5,10H2,1-3H3/b14-11+.
What are the key properties of 1-(4-ethylphenyl)-N-propylethanimine?
1-(4-ethylphenyl)-N-propylethanimine has a molecular weight of 189.30 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-N-propylethanimine is sourced from PubChem (CID 146572817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).