(2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine

C15H19NO2 — CID 106682403

IUPAC(2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine
SMILESCOc1cc(C)cc(C)c1C(N)c1coc(C)c1
InChIInChI=1S/C15H19NO2/c1-9-5-10(2)14(13(6-9)17-4)15(16)12-7-11(3)18-8-12/h5-8,15H,16H2,1-4H3
InChIKeySHALBEXMEGBDOI-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.26
Rot. Bonds3

About (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine

(2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine (PubChem CID 106682403) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine.

Molecular Properties

Compound Name(2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine
PubChem CID106682403
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name(2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine
SMILESCOc1cc(C)cc(C)c1C(N)c1coc(C)c1
InChIInChI=1S/C15H19NO2/c1-9-5-10(2)14(13(6-9)17-4)15(16)12-7-11(3)18-8-12/h5-8,15H,16H2,1-4H3
InChIKeySHALBEXMEGBDOI-UHFFFAOYSA-N
XLogP3.26
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methoxy-4,6-dimethylphenyl)-(4-methoxyphenyl)methanamine
CID 106680347
(2-methoxy-4,6-dimethylphenyl)-(3-methylphenyl)methanamine
CID 106680388
(4-ethylsulfanylphenyl)-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 106848613
(3,4-dichlorophenyl)-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 106680831
(2-methoxy-4,6-dimethylphenyl)-(2-methoxy-4-methylphenyl)methanamine
CID 106791356
(3,5-dimethylphenyl)-(5-methylfuran-3-yl)methanamine
CID 115796793
(3-bromo-2,4,6-trimethylphenyl)-(5-methylfuran-3-yl)methanamine
CID 114249239
2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 77129779
(2-bromophenyl)-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 106680488
(2-methoxy-4,6-dimethylphenyl)-(6-methyl-2-pyridinyl)methanamine
CID 106680561
(5-chloro-2-fluorophenyl)-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 106680991
cyclooctyl-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 106680816

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine?
The IUPAC name of (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine (CID 106682403) is (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine.
What is the SMILES notation for (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine?
The canonical SMILES for (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine is COc1cc(C)cc(C)c1C(N)c1coc(C)c1.
What is the InChIKey of (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine?
The InChIKey is SHALBEXMEGBDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-9-5-10(2)14(13(6-9)17-4)15(16)12-7-11(3)18-8-12/h5-8,15H,16H2,1-4H3.
What are the key properties of (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine?
(2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine has a molecular weight of 245.32 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-4,6-dimethylphenyl)-(5-methylfuran-3-yl)methanamine is sourced from PubChem (CID 106682403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).