2,5-dimethoxy-N-(4-methylphenyl)aniline

C15H17NO2 — CID 171920056

IUPAC2,5-dimethoxy-N-(4-methylphenyl)aniline
SMILESCOc1ccc(OC)c(Nc2ccc(C)cc2)c1
InChIInChI=1S/C15H17NO2/c1-11-4-6-12(7-5-11)16-14-10-13(17-2)8-9-15(14)18-3/h4-10,16H,1-3H3
InChIKeyJVUNTSSZTCCVSH-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.76
Rot. Bonds4

About 2,5-dimethoxy-N-(4-methylphenyl)aniline

2,5-dimethoxy-N-(4-methylphenyl)aniline (PubChem CID 171920056) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2,5-dimethoxy-N-(4-methylphenyl)aniline.

Molecular Properties

Compound Name2,5-dimethoxy-N-(4-methylphenyl)aniline
PubChem CID171920056
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2,5-dimethoxy-N-(4-methylphenyl)aniline
SMILESCOc1ccc(OC)c(Nc2ccc(C)cc2)c1
InChIInChI=1S/C15H17NO2/c1-11-4-6-12(7-5-11)16-14-10-13(17-2)8-9-15(14)18-3/h4-10,16H,1-3H3
InChIKeyJVUNTSSZTCCVSH-UHFFFAOYSA-N
XLogP3.76
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide
CID 112987885
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]-4-methylbenzamide
CID 113034626
4-methoxy-2-(4-methylanilino)benzenecarbothioamide
CID 81306668
5-methoxy-N-(4-methylphenyl)-2-nitroaniline
CID 67365056
4-N-(2,5-dimethoxyphenyl)-2-N-(4-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
CID 112930724
N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109200105
N-[4-(aminomethyl)phenyl]-2-methoxy-5-methylaniline
CID 117027386
N-[4-(2-methoxy-5-methylanilino)phenyl]acetamide
CID 112987716
4-N-(2,5-dimethoxyphenyl)-6-N-(4-fluorophenyl)-2-methylpyrimidine-4,6-diamine
CID 112877885
N-(2,5-dimethoxyphenyl)-4-methylpyridin-2-amine
CID 91756707
N-(2,5-dimethoxyphenyl)-2-(4-methylanilino)pyridine-4-carboxamide
CID 109176317
1-N'-(2,5-dimethoxyphenyl)-1-N-(4-methylphenyl)cyclopropane-1,1-dicarboxamide
CID 108980885

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-(4-methylphenyl)aniline?
The IUPAC name of 2,5-dimethoxy-N-(4-methylphenyl)aniline (CID 171920056) is 2,5-dimethoxy-N-(4-methylphenyl)aniline.
What is the SMILES notation for 2,5-dimethoxy-N-(4-methylphenyl)aniline?
The canonical SMILES for 2,5-dimethoxy-N-(4-methylphenyl)aniline is COc1ccc(OC)c(Nc2ccc(C)cc2)c1.
What is the InChIKey of 2,5-dimethoxy-N-(4-methylphenyl)aniline?
The InChIKey is JVUNTSSZTCCVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-11-4-6-12(7-5-11)16-14-10-13(17-2)8-9-15(14)18-3/h4-10,16H,1-3H3.
What are the key properties of 2,5-dimethoxy-N-(4-methylphenyl)aniline?
2,5-dimethoxy-N-(4-methylphenyl)aniline has a molecular weight of 243.31 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-(4-methylphenyl)aniline is sourced from PubChem (CID 171920056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).