N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline

C17H21NO — CID 146163191

IUPACN-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline
SMILESCOc1cc(C)c(Nc2c(C)cccc2C)c(C)c1
InChIInChI=1S/C17H21NO/c1-11-7-6-8-12(2)16(11)18-17-13(3)9-15(19-5)10-14(17)4/h6-10,18H,1-5H3
InChIKeyNUGNITGQPDJTOO-UHFFFAOYSA-N
MW255.36 g/mol
LogP4.67
Rot. Bonds3

About N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline

N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline (PubChem CID 146163191) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline
PubChem CID146163191
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC NameN-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline
SMILESCOc1cc(C)c(Nc2c(C)cccc2C)c(C)c1
InChIInChI=1S/C17H21NO/c1-11-7-6-8-12(2)16(11)18-17-13(3)9-15(19-5)10-14(17)4/h6-10,18H,1-5H3
InChIKeyNUGNITGQPDJTOO-UHFFFAOYSA-N
XLogP4.67
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,2-N-bis(2,6-dimethylphenyl)-4,5-dimethoxybenzene-1,2-diamine
CID 86003268
N-ethyl-4-methoxy-2,6-dimethylaniline
CID 23348858
N-(4-methoxy-2,6-dimethylphenyl)acetamide
CID 5268765
N-methoxy-2,6-dimethylaniline
CID 142628906
2-N-(2,6-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
CID 112928423
2,6-bis(4-methoxy-2,6-dimethylphenyl)pyridine
CID 71374375
2-chloro-4-methoxy-N,6-dimethylaniline
CID 23348982
2-(2,6-difluoro-4-methoxyphenyl)-N-(2,6-dimethylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 59578866
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-3,5-dimethoxybenzamide
CID 113032259
ethene;4-methoxy-1,2-dimethylbenzene
CID 145003805
ethane;4-methoxy-1,2-dimethylbenzene;5-methoxy-1,2,3-trimethylbenzene
CID 171649028
2-N-(2,6-dimethylphenyl)-4-N-[(4-methoxyphenyl)methyl]-6-methylpyrimidine-2,4-diamine
CID 112918471

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline?
The IUPAC name of N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline (CID 146163191) is N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline.
What is the SMILES notation for N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline?
The canonical SMILES for N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline is COc1cc(C)c(Nc2c(C)cccc2C)c(C)c1.
What is the InChIKey of N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline?
The InChIKey is NUGNITGQPDJTOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-11-7-6-8-12(2)16(11)18-17-13(3)9-15(19-5)10-14(17)4/h6-10,18H,1-5H3.
What are the key properties of N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline?
N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline has a molecular weight of 255.36 g/mol, XLogP of 4.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-4-methoxy-2,6-dimethylaniline is sourced from PubChem (CID 146163191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).