2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine

C12H19NO — CID 82048609

IUPAC2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine
SMILESCOc1cc(C)c(C(C)(C)N)c(C)c1
InChIInChI=1S/C12H19NO/c1-8-6-10(14-5)7-9(2)11(8)12(3,4)13/h6-7H,13H2,1-5H3
InChIKeyREFMYBXQDYYDHW-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.51
Rot. Bonds2

About 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine

2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine (PubChem CID 82048609) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine.

Molecular Properties

Compound Name2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine
PubChem CID82048609
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine
SMILESCOc1cc(C)c(C(C)(C)N)c(C)c1
InChIInChI=1S/C12H19NO/c1-8-6-10(14-5)7-9(2)11(8)12(3,4)13/h6-7H,13H2,1-5H3
InChIKeyREFMYBXQDYYDHW-UHFFFAOYSA-N
XLogP2.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methoxy-2,6-dimethylphenyl)methanamine
CID 82266532
2-(5-methoxy-1,3,7-trimethylindol-2-yl)propan-2-amine
CID 84632481
5-methoxy-1-[2-(5-methoxy-2,3-dimethylphenyl)propan-2-yl]-2,3-dimethylbenzene
CID 20693410
2-(2,5-dimethoxy-3,6-dimethylphenyl)propan-2-amine
CID 117320504
1-(2,4-dimethoxy-6-methylphenyl)-1-N,1-N,2-trimethylpropane-1,2-diamine
CID 116904559
1-N-(2,4-dimethoxy-6-methylphenyl)-3-methylbutane-1,3-diamine
CID 115200420
4-(2,4-dimethoxy-6-methylphenyl)-3,3-dimethylbutan-1-amine
CID 116925176
3-(2,4-dimethoxy-6-methylphenyl)-3-methylbutanoic acid
CID 117384014
1-(2,4-dimethoxy-6-methylphenyl)-1-N,2-dimethylpropane-1,2-diamine
CID 116948303
2-(2,4,6-trimethoxyphenyl)propane-1,2-diamine
CID 116855607
O-[(4-methoxy-2-methylphenyl)methyl]hydroxylamine
CID 117276532
4-methoxy-2-methyl-6-(trifluoromethyl)aniline
CID 19842533

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine?
The IUPAC name of 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine (CID 82048609) is 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine.
What is the SMILES notation for 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine?
The canonical SMILES for 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine is COc1cc(C)c(C(C)(C)N)c(C)c1.
What is the InChIKey of 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine?
The InChIKey is REFMYBXQDYYDHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-8-6-10(14-5)7-9(2)11(8)12(3,4)13/h6-7H,13H2,1-5H3.
What are the key properties of 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine?
2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-2,6-dimethylphenyl)propan-2-amine is sourced from PubChem (CID 82048609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).