2-(4-methoxyphenyl)-6-methylaniline

C14H15NO — CID 172649945

IUPAC2-(4-methoxyphenyl)-6-methylaniline
SMILESCOc1ccc(-c2cccc(C)c2N)cc1
InChIInChI=1S/C14H15NO/c1-10-4-3-5-13(14(10)15)11-6-8-12(16-2)9-7-11/h3-9H,15H2,1-2H3
InChIKeyLRKQLOMJFHUSFF-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.25
Rot. Bonds2

About 2-(4-methoxyphenyl)-6-methylaniline

2-(4-methoxyphenyl)-6-methylaniline (PubChem CID 172649945) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-6-methylaniline.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-6-methylaniline
PubChem CID172649945
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name2-(4-methoxyphenyl)-6-methylaniline
SMILESCOc1ccc(-c2cccc(C)c2N)cc1
InChIInChI=1S/C14H15NO/c1-10-4-3-5-13(14(10)15)11-6-8-12(16-2)9-7-11/h3-9H,15H2,1-2H3
InChIKeyLRKQLOMJFHUSFF-UHFFFAOYSA-N
XLogP3.25
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(4-methoxyphenyl)-6-methylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-methoxyphenyl)-5-(4-methylphenyl)naphthalene
CID 142669243
methyl 2-amino-3-(4-methoxyphenyl)benzoate
CID 171919931
2-[[2,6-bis(4-methoxyphenyl)phenyl]disulfanyl]-1,3-bis(4-methoxyphenyl)benzene
CID 87488450
2-(2-methoxy-4-pyridinyl)-6-methylaniline
CID 165370001
1,3-bis(4-methoxyphenyl)-2-methylsulfanylbenzene
CID 50916407
2-amino-6-(4-methoxyphenyl)benzonitrile
CID 146018328
2-[(4-methoxyphenyl)methoxy]-6-methylaniline
CID 43381877
1,2-difluoro-3-(4-methoxyphenyl)benzene
CID 59532996
3-(4-methoxyphenyl)-2-(2-methylprop-1-enyl)aniline
CID 10377586
4-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 147099645
4-(4-methoxyphenyl)-1H-indazol-3-amine
CID 118046988
3,4-bis(4-methoxyphenyl)-6-phenylbenzene-1,2-diamine
CID 87111772

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-6-methylaniline?
The IUPAC name of 2-(4-methoxyphenyl)-6-methylaniline (CID 172649945) is 2-(4-methoxyphenyl)-6-methylaniline.
What is the SMILES notation for 2-(4-methoxyphenyl)-6-methylaniline?
The canonical SMILES for 2-(4-methoxyphenyl)-6-methylaniline is COc1ccc(-c2cccc(C)c2N)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-6-methylaniline?
The InChIKey is LRKQLOMJFHUSFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-10-4-3-5-13(14(10)15)11-6-8-12(16-2)9-7-11/h3-9H,15H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-6-methylaniline?
2-(4-methoxyphenyl)-6-methylaniline has a molecular weight of 213.28 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-6-methylaniline is sourced from PubChem (CID 172649945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).