(2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine

C17H20FNO2 — CID 106877206

IUPAC(2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine
SMILESCOc1ccc(C(N)c2c(C)cc(F)cc2C)c(OC)c1
InChIInChI=1S/C17H20FNO2/c1-10-7-12(18)8-11(2)16(10)17(19)14-6-5-13(20-3)9-15(14)21-4/h5-9,17H,19H2,1-4H3
InChIKeyGWAMMEDXVMGTAX-UHFFFAOYSA-N
MW289.35 g/mol
LogP3.51
Rot. Bonds4

About (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine

(2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine (PubChem CID 106877206) has the molecular formula C17H20FNO2 and a molecular weight of 289.35 g/mol. Its IUPAC name is (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine.

Molecular Properties

Compound Name(2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine
PubChem CID106877206
Molecular FormulaC17H20FNO2
Molecular Weight289.35 g/mol
Exact Mass289.15
IUPAC Name(2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine
SMILESCOc1ccc(C(N)c2c(C)cc(F)cc2C)c(OC)c1
InChIInChI=1S/C17H20FNO2/c1-10-7-12(18)8-11(2)16(10)17(19)14-6-5-13(20-3)9-15(14)21-4/h5-9,17H,19H2,1-4H3
InChIKeyGWAMMEDXVMGTAX-UHFFFAOYSA-N
XLogP3.51
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,4-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanamine
CID 43198782
(2,4-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 81477695
(3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
CID 43248329
(2,4-dimethoxyphenyl)-(2,4-dimethylphenyl)methanamine
CID 43197259
(2-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
CID 43197258
(4-chloro-2-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
CID 43197289
(2,4-dimethoxyphenyl)-(2,3-dimethylphenyl)methanamine
CID 43197264
(2,4-dimethoxyphenyl)-(3,5-dimethylthiophen-2-yl)methanamine
CID 81156141
amino-(2,4-dimethoxyphenyl)methanol
CID 116939607
(2-fluoro-4-methoxyphenyl)-(2,3,5,6-tetramethylphenyl)methanamine
CID 102882564
(2,4-dimethoxyphenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089367
(2,6-dimethoxyphenyl)-(2-fluoro-4-methoxyphenyl)methanamine
CID 43561193

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine?
The IUPAC name of (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine (CID 106877206) is (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine.
What is the SMILES notation for (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine?
The canonical SMILES for (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine is COc1ccc(C(N)c2c(C)cc(F)cc2C)c(OC)c1.
What is the InChIKey of (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine?
The InChIKey is GWAMMEDXVMGTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO2/c1-10-7-12(18)8-11(2)16(10)17(19)14-6-5-13(20-3)9-15(14)21-4/h5-9,17H,19H2,1-4H3.
What are the key properties of (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine?
(2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine has a molecular weight of 289.35 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine is sourced from PubChem (CID 106877206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).