N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline

C19H26N2 — CID 63551214

IUPACN-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline
SMILESCCNCc1ccc(N(CC)c2ccc(C)cc2)c(C)c1
InChIInChI=1S/C19H26N2/c1-5-20-14-17-9-12-19(16(4)13-17)21(6-2)18-10-7-15(3)8-11-18/h7-13,20H,5-6,14H2,1-4H3
InChIKeyOILFDHLBSOGTJY-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.57
Rot. Bonds6

About N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline

N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline (PubChem CID 63551214) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline.

Molecular Properties

Compound NameN-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline
PubChem CID63551214
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline
SMILESCCNCc1ccc(N(CC)c2ccc(C)cc2)c(C)c1
InChIInChI=1S/C19H26N2/c1-5-20-14-17-9-12-19(16(4)13-17)21(6-2)18-10-7-15(3)8-11-18/h7-13,20H,5-6,14H2,1-4H3
InChIKeyOILFDHLBSOGTJY-UHFFFAOYSA-N
XLogP4.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(N-ethyl-4-methylanilino)-3-methylphenyl]methanol
CID 62122401
1-N-ethyl-2-methyl-1-N-(4-methylphenyl)benzene-1,4-diamine
CID 62003547
4-(N-ethyl-4-methylanilino)-3-methylbenzaldehyde
CID 63536813
N-ethyl-N-[4-(ethylaminomethyl)phenyl]-3-methylaniline
CID 63550597
N-[(4-methylphenyl)methyl]ethanamine
CID 4716476
N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(2-methylpropyl)aniline
CID 62121360
N-butan-2-yl-4-(ethylaminomethyl)-N,2-dimethylaniline
CID 62121015
N-(2,2-dimethylpropyl)-4-(ethylaminomethyl)-N,2-dimethylaniline
CID 62122953
N,N-diethyl-2-[4-(ethylaminomethyl)-N,2-dimethylanilino]acetamide
CID 62124186
2-N-ethyl-2-N-[4-(ethylaminomethyl)-2-methylphenyl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 103190030
3-chloro-N-ethyl-2-(ethylaminomethyl)-N-(4-methylphenyl)aniline
CID 63551401
N-ethyl-N-(3-fluorophenyl)-2-methyl-4-(methylaminomethyl)aniline
CID 62122777

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline?
The IUPAC name of N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline (CID 63551214) is N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline.
What is the SMILES notation for N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline?
The canonical SMILES for N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline is CCNCc1ccc(N(CC)c2ccc(C)cc2)c(C)c1.
What is the InChIKey of N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline?
The InChIKey is OILFDHLBSOGTJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-5-20-14-17-9-12-19(16(4)13-17)21(6-2)18-10-7-15(3)8-11-18/h7-13,20H,5-6,14H2,1-4H3.
What are the key properties of N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline?
N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline has a molecular weight of 282.43 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(ethylaminomethyl)-2-methyl-N-(4-methylphenyl)aniline is sourced from PubChem (CID 63551214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).