(2,6-dimethoxy-4-methylphenyl)methanamine

C10H15NO2 — CID 58024962

IUPAC(2,6-dimethoxy-4-methylphenyl)methanamine
SMILESCOc1cc(C)cc(OC)c1CN
InChIInChI=1S/C10H15NO2/c1-7-4-9(12-2)8(6-11)10(5-7)13-3/h4-5H,6,11H2,1-3H3
InChIKeyXABCFCRJXKIIHM-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.47
Rot. Bonds3

About (2,6-dimethoxy-4-methylphenyl)methanamine

(2,6-dimethoxy-4-methylphenyl)methanamine (PubChem CID 58024962) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is (2,6-dimethoxy-4-methylphenyl)methanamine.

Molecular Properties

Compound Name(2,6-dimethoxy-4-methylphenyl)methanamine
PubChem CID58024962
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name(2,6-dimethoxy-4-methylphenyl)methanamine
SMILESCOc1cc(C)cc(OC)c1CN
InChIInChI=1S/C10H15NO2/c1-7-4-9(12-2)8(6-11)10(5-7)13-3/h4-5H,6,11H2,1-3H3
InChIKeyXABCFCRJXKIIHM-UHFFFAOYSA-N
XLogP1.47
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-bromo-2,6-dimethoxyphenyl)methanamine
CID 130139852
(3-methoxy-2,5-dimethylphenyl)methanamine
CID 119023643
2-(2,2-dimethylpropyl)-1,3-dimethoxy-5-methylbenzene
CID 59743812
[4-(aminomethyl)-3,5-dimethoxyphenoxy]boronic acid
CID 174501310
1,3-dimethoxy-5-methyl-2-prop-2-enylbenzene
CID 86017681
2-ethyl-1-methoxy-3,5-dimethylbenzene;propane
CID 170973865
1,3-dimethoxy-2,5-dimethylbenzene
CID 524839
1-(2-methoxy-4,6-dimethylphenyl)-2-methylpropan-2-amine
CID 82470482
4-[4-(aminomethyl)-3,5-dimethoxyphenoxy]butanoic acid
CID 68627883
2-[(2-methoxy-4,6-dimethylphenyl)methyl]-3-methylbutan-1-amine
CID 116931118
N-[(2,6-dimethoxy-4-methylphenyl)methyl]propan-2-amine
CID 145435829
(2,4-dimethoxy-3,6-dimethylphenyl)methanamine
CID 84666288

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxy-4-methylphenyl)methanamine?
The IUPAC name of (2,6-dimethoxy-4-methylphenyl)methanamine (CID 58024962) is (2,6-dimethoxy-4-methylphenyl)methanamine.
What is the SMILES notation for (2,6-dimethoxy-4-methylphenyl)methanamine?
The canonical SMILES for (2,6-dimethoxy-4-methylphenyl)methanamine is COc1cc(C)cc(OC)c1CN.
What is the InChIKey of (2,6-dimethoxy-4-methylphenyl)methanamine?
The InChIKey is XABCFCRJXKIIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-7-4-9(12-2)8(6-11)10(5-7)13-3/h4-5H,6,11H2,1-3H3.
What are the key properties of (2,6-dimethoxy-4-methylphenyl)methanamine?
(2,6-dimethoxy-4-methylphenyl)methanamine has a molecular weight of 181.23 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxy-4-methylphenyl)methanamine is sourced from PubChem (CID 58024962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).