(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine

C17H21NO3 — CID 43626072

IUPAC(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
SMILESCOc1ccc(C)cc1C(N)c1c(OC)cccc1OC
InChIInChI=1S/C17H21NO3/c1-11-8-9-13(19-2)12(10-11)17(18)16-14(20-3)6-5-7-15(16)21-4/h5-10,17H,18H2,1-4H3
InChIKeyCPEIPHYMBUXWCU-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.07
Rot. Bonds5

About (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine

(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine (PubChem CID 43626072) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine.

Molecular Properties

Compound Name(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
PubChem CID43626072
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC Name(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
SMILESCOc1ccc(C)cc1C(N)c1c(OC)cccc1OC
InChIInChI=1S/C17H21NO3/c1-11-8-9-13(19-2)12(10-11)17(18)16-14(20-3)6-5-7-15(16)21-4/h5-10,17H,18H2,1-4H3
InChIKeyCPEIPHYMBUXWCU-UHFFFAOYSA-N
XLogP3.07
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 65434780
(2,6-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 43122398
(2-chloro-6-fluorophenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 43626075
(2,6-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 105051988
(2,6-difluorophenyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 43122336
(2-chloro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 104817103
(2,6-dimethoxyphenyl)-(2,4,5-trifluorophenyl)methanamine
CID 103301943
(3-fluoro-4-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 62505966
(2-methoxy-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine
CID 62505242
2,3-dihydro-1-benzofuran-7-yl-(2-methoxy-5-methylphenyl)methanamine
CID 105053233
(2-methoxy-5-methylphenyl)-(5-methyl-1-benzofuran-2-yl)methanamine
CID 63326884
(2-methoxy-5-methylphenyl)-(3-methylthiophen-2-yl)methanamine
CID 43626117

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
The IUPAC name of (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine (CID 43626072) is (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine.
What is the SMILES notation for (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
The canonical SMILES for (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine is COc1ccc(C)cc1C(N)c1c(OC)cccc1OC.
What is the InChIKey of (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
The InChIKey is CPEIPHYMBUXWCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-11-8-9-13(19-2)12(10-11)17(18)16-14(20-3)6-5-7-15(16)21-4/h5-10,17H,18H2,1-4H3.
What are the key properties of (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine has a molecular weight of 287.36 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine is sourced from PubChem (CID 43626072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).