(4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine

C18H23NO2 — CID 83044207

IUPAC(4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine
SMILESCOc1cc(C(N)c2cc(C)c(OC)c(C)c2)ccc1C
InChIInChI=1S/C18H23NO2/c1-11-6-7-14(10-16(11)20-4)17(19)15-8-12(2)18(21-5)13(3)9-15/h6-10,17H,19H2,1-5H3
InChIKeyBURSFBACCJXEQK-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.68
Rot. Bonds4

About (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine

(4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine (PubChem CID 83044207) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine.

Molecular Properties

Compound Name(4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine
PubChem CID83044207
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name(4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine
SMILESCOc1cc(C(N)c2cc(C)c(OC)c(C)c2)ccc1C
InChIInChI=1S/C18H23NO2/c1-11-6-7-14(10-16(11)20-4)17(19)15-8-12(2)18(21-5)13(3)9-15/h6-10,17H,19H2,1-5H3
InChIKeyBURSFBACCJXEQK-UHFFFAOYSA-N
XLogP3.68
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,4-dimethylphenyl)-(4-methoxy-3,5-dimethylphenyl)methanamine
CID 83056988
(4-fluoro-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine
CID 65298951
(4-methoxy-3,5-dimethylphenyl)-(4-methylphenyl)methanamine
CID 83056835
(3-methoxy-4-methylphenyl)-pyrimidin-5-ylmethanamine
CID 115827248
2,3-dihydro-1,4-benzodioxin-6-yl-(3-methoxy-4-methylphenyl)methanamine
CID 43186694
(4-chloro-3-methoxyphenyl)-(3,4-dimethylphenyl)methanamine
CID 105006817
(2,4-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine
CID 43198537
1,3-dihydro-2-benzofuran-5-yl-(4-methoxy-3,5-dimethylphenyl)methanamine
CID 83044016
(1S)-1-(3-methoxy-4-methylphenyl)-2,2-dimethylpropan-1-amine
CID 131536439
(1S,2S)-1-(3-methoxy-4-methylphenyl)propane-1,2-diamine
CID 130934760
(3-methoxy-4-methylphenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine
CID 43297193
5-[amino-(3-methoxy-4-methylphenyl)methyl]-1,3-dihydrobenzimidazol-2-one
CID 43186872

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine?
The IUPAC name of (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine (CID 83044207) is (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine.
What is the SMILES notation for (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine?
The canonical SMILES for (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine is COc1cc(C(N)c2cc(C)c(OC)c(C)c2)ccc1C.
What is the InChIKey of (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine?
The InChIKey is BURSFBACCJXEQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-11-6-7-14(10-16(11)20-4)17(19)15-8-12(2)18(21-5)13(3)9-15/h6-10,17H,19H2,1-5H3.
What are the key properties of (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine?
(4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine has a molecular weight of 285.39 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3,5-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanamine is sourced from PubChem (CID 83044207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).