N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine

C19H25NO — CID 63473491

IUPACN-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine
SMILESCNC(COc1cc(C)cc(C)c1C)c1ccccc1C
InChIInChI=1S/C19H25NO/c1-13-10-15(3)16(4)19(11-13)21-12-18(20-5)17-9-7-6-8-14(17)2/h6-11,18,20H,12H2,1-5H3
InChIKeyKVBRXSUSZWGLQV-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.26
Rot. Bonds5

About N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine

N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine (PubChem CID 63473491) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine
PubChem CID63473491
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC NameN-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine
SMILESCNC(COc1cc(C)cc(C)c1C)c1ccccc1C
InChIInChI=1S/C19H25NO/c1-13-10-15(3)16(4)19(11-13)21-12-18(20-5)17-9-7-6-8-14(17)2/h6-11,18,20H,12H2,1-5H3
InChIKeyKVBRXSUSZWGLQV-UHFFFAOYSA-N
XLogP4.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4-methylphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine
CID 62670922
N-methyl-1-(4-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine
CID 63474209
2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine
CID 63476135
2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine
CID 62335577
N-ethyl-2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine
CID 64855007
2-(2,3-dimethylphenoxy)-N-ethyl-1-(2-methylphenyl)ethanamine
CID 63476125
2-(2-chloro-4-methylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine
CID 63500567
2-(2-chlorophenoxy)-N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 63499644
2-(2,3-dimethylphenoxy)-N-methyl-1-phenylethanamine;hydrochloride
CID 164625435
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-phenoxyethanamine
CID 106680529
N-methyl-1-(2-methylphenyl)-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106447365
1-cyclopropyl-N-methyl-2-(2,3,5-trimethylphenoxy)ethanamine
CID 63907720

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine?
The IUPAC name of N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine (CID 63473491) is N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine.
What is the SMILES notation for N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine?
The canonical SMILES for N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine is CNC(COc1cc(C)cc(C)c1C)c1ccccc1C.
What is the InChIKey of N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine?
The InChIKey is KVBRXSUSZWGLQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13-10-15(3)16(4)19(11-13)21-12-18(20-5)17-9-7-6-8-14(17)2/h6-11,18,20H,12H2,1-5H3.
What are the key properties of N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine?
N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine has a molecular weight of 283.42 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine is sourced from PubChem (CID 63473491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).