N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline

C18H23NO2 — CID 60924688

IUPACN-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline
SMILESCCc1cccc(C)c1NCc1cc(OC)ccc1OC
InChIInChI=1S/C18H23NO2/c1-5-14-8-6-7-13(2)18(14)19-12-15-11-16(20-3)9-10-17(15)21-4/h6-11,19H,5,12H2,1-4H3
InChIKeyHSXVAOCAHQZLNT-UHFFFAOYSA-N
MW285.39 g/mol
LogP4.19
Rot. Bonds6

About N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline

N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline (PubChem CID 60924688) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline.

Molecular Properties

Compound NameN-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline
PubChem CID60924688
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC NameN-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline
SMILESCCc1cccc(C)c1NCc1cc(OC)ccc1OC
InChIInChI=1S/C18H23NO2/c1-5-14-8-6-7-13(2)18(14)19-12-15-11-16(20-3)9-10-17(15)21-4/h6-11,19H,5,12H2,1-4H3
InChIKeyHSXVAOCAHQZLNT-UHFFFAOYSA-N
XLogP4.19
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-ethyl-6-methylanilino)methyl]-4-methoxyphenol
CID 60925001
2-(2,5-dimethoxyphenyl)-N-(2-ethyl-6-methylphenyl)acetamide
CID 7992499
2-(2,4-dimethoxyanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 8965693
N-[(2,5-dimethoxyphenyl)methyl]-3,4-dimethylaniline
CID 791602
2-(2,5-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 78806562
N'-(2-ethyl-6-methylphenyl)-N-(2-methoxyphenyl)ethane-1,2-diamine
CID 54810086
1-(2,3-dimethoxyphenyl)-N-[(2,5-dimethoxyphenyl)methyl]methanamine
CID 23882259
N-[[2-(difluoromethoxy)phenyl]methyl]-2-ethyl-6-methylaniline
CID 60924885
3-(2-ethyl-6-methylanilino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 109022011
2-ethyl-6-methyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
CID 62475131
N-[(2,5-dimethoxyphenyl)methyl]thiophen-3-amine
CID 66351900
(3R)-1-(2,4-dimethoxyphenyl)-N-(2-ethyl-6-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9351616

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline?
The IUPAC name of N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline (CID 60924688) is N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline.
What is the SMILES notation for N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline?
The canonical SMILES for N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline is CCc1cccc(C)c1NCc1cc(OC)ccc1OC.
What is the InChIKey of N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline?
The InChIKey is HSXVAOCAHQZLNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-5-14-8-6-7-13(2)18(14)19-12-15-11-16(20-3)9-10-17(15)21-4/h6-11,19H,5,12H2,1-4H3.
What are the key properties of N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline?
N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline has a molecular weight of 285.39 g/mol, XLogP of 4.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethoxyphenyl)methyl]-2-ethyl-6-methylaniline is sourced from PubChem (CID 60924688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).