3-ethyl-N-(4-methylphenyl)aniline

C15H17N — CID 139833776

IUPAC3-ethyl-N-(4-methylphenyl)aniline
SMILESCCc1cccc(Nc2ccc(C)cc2)c1
InChIInChI=1S/C15H17N/c1-3-13-5-4-6-15(11-13)16-14-9-7-12(2)8-10-14/h4-11,16H,3H2,1-2H3
InChIKeyPDFSDUBVGVVQPH-UHFFFAOYSA-N
MW211.31 g/mol
LogP4.30
Rot. Bonds3

About 3-ethyl-N-(4-methylphenyl)aniline

3-ethyl-N-(4-methylphenyl)aniline (PubChem CID 139833776) has the molecular formula C15H17N and a molecular weight of 211.31 g/mol. Its IUPAC name is 3-ethyl-N-(4-methylphenyl)aniline.

Molecular Properties

Compound Name3-ethyl-N-(4-methylphenyl)aniline
PubChem CID139833776
Molecular FormulaC15H17N
Molecular Weight211.31 g/mol
Exact Mass211.14
IUPAC Name3-ethyl-N-(4-methylphenyl)aniline
SMILESCCc1cccc(Nc2ccc(C)cc2)c1
InChIInChI=1S/C15H17N/c1-3-13-5-4-6-15(11-13)16-14-9-7-12(2)8-10-14/h4-11,16H,3H2,1-2H3
InChIKeyPDFSDUBVGVVQPH-UHFFFAOYSA-N
XLogP4.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3-(4-methylanilino)phenyl]acetic acid
CID 155290701
2,6-diethyl-N-(3-ethylphenyl)aniline
CID 139833761
1,3-diethylbenzene;1,4-diethylbenzene;methane;1,4-xylene
CID 158740154
2-(3-ethylanilino)-4-methylbenzonitrile
CID 55195560
2-(3-ethylanilino)-N-(4-methylphenyl)propanamide
CID 60638712
3-tert-butyl-N-(4-methylphenyl)aniline
CID 166638036
N-(4-ethylphenyl)-3-phenylaniline
CID 142244163
2-N-(3-ethylphenyl)-3-methylbenzene-1,2-diamine
CID 113333679
3-bromo-N-(3-ethylphenyl)-5-methylpyridin-2-amine
CID 105367623
1-[2-amino-4-(3-ethylanilino)phenyl]ethanone
CID 104528330
5-bromo-N-(3-ethylphenyl)pyridin-3-amine
CID 104531520
1-N-(3-ethylphenyl)-2-methylbenzene-1,4-diamine
CID 43165595

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(4-methylphenyl)aniline?
The IUPAC name of 3-ethyl-N-(4-methylphenyl)aniline (CID 139833776) is 3-ethyl-N-(4-methylphenyl)aniline.
What is the SMILES notation for 3-ethyl-N-(4-methylphenyl)aniline?
The canonical SMILES for 3-ethyl-N-(4-methylphenyl)aniline is CCc1cccc(Nc2ccc(C)cc2)c1.
What is the InChIKey of 3-ethyl-N-(4-methylphenyl)aniline?
The InChIKey is PDFSDUBVGVVQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N/c1-3-13-5-4-6-15(11-13)16-14-9-7-12(2)8-10-14/h4-11,16H,3H2,1-2H3.
What are the key properties of 3-ethyl-N-(4-methylphenyl)aniline?
3-ethyl-N-(4-methylphenyl)aniline has a molecular weight of 211.31 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(4-methylphenyl)aniline is sourced from PubChem (CID 139833776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).