N-(3-methoxyphenyl)-2,4,6-trimethylaniline

C16H19NO — CID 15712171

IUPACN-(3-methoxyphenyl)-2,4,6-trimethylaniline
SMILESCOc1cccc(Nc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C16H19NO/c1-11-8-12(2)16(13(3)9-11)17-14-6-5-7-15(10-14)18-4/h5-10,17H,1-4H3
InChIKeyVFCZKTCPEPGZED-UHFFFAOYSA-N
MW241.33 g/mol
LogP4.36
Rot. Bonds3

About N-(3-methoxyphenyl)-2,4,6-trimethylaniline

N-(3-methoxyphenyl)-2,4,6-trimethylaniline (PubChem CID 15712171) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2,4,6-trimethylaniline.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2,4,6-trimethylaniline
PubChem CID15712171
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-(3-methoxyphenyl)-2,4,6-trimethylaniline
SMILESCOc1cccc(Nc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C16H19NO/c1-11-8-12(2)16(13(3)9-11)17-14-6-5-7-15(10-14)18-4/h5-10,17H,1-4H3
InChIKeyVFCZKTCPEPGZED-UHFFFAOYSA-N
XLogP4.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2,4,6-trimethylaniline?
The IUPAC name of N-(3-methoxyphenyl)-2,4,6-trimethylaniline (CID 15712171) is N-(3-methoxyphenyl)-2,4,6-trimethylaniline.
What is the SMILES notation for N-(3-methoxyphenyl)-2,4,6-trimethylaniline?
The canonical SMILES for N-(3-methoxyphenyl)-2,4,6-trimethylaniline is COc1cccc(Nc2c(C)cc(C)cc2C)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2,4,6-trimethylaniline?
The InChIKey is VFCZKTCPEPGZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-11-8-12(2)16(13(3)9-11)17-14-6-5-7-15(10-14)18-4/h5-10,17H,1-4H3.
What are the key properties of N-(3-methoxyphenyl)-2,4,6-trimethylaniline?
N-(3-methoxyphenyl)-2,4,6-trimethylaniline has a molecular weight of 241.33 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2,4,6-trimethylaniline is sourced from PubChem (CID 15712171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).