(2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine

C16H18FNO2 — CID 65434780

IUPAC(2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
SMILESCOc1ccc(C)cc1C(N)c1c(F)cccc1OC
InChIInChI=1S/C16H18FNO2/c1-10-7-8-13(19-2)11(9-10)16(18)15-12(17)5-4-6-14(15)20-3/h4-9,16H,18H2,1-3H3
InChIKeyUPILCQQOOCJBLP-UHFFFAOYSA-N
MW275.32 g/mol
LogP3.20
Rot. Bonds4

About (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine

(2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine (PubChem CID 65434780) has the molecular formula C16H18FNO2 and a molecular weight of 275.32 g/mol. Its IUPAC name is (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine.

Molecular Properties

Compound Name(2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
PubChem CID65434780
Molecular FormulaC16H18FNO2
Molecular Weight275.32 g/mol
Exact Mass275.13
IUPAC Name(2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
SMILESCOc1ccc(C)cc1C(N)c1c(F)cccc1OC
InChIInChI=1S/C16H18FNO2/c1-10-7-8-13(19-2)11(9-10)16(18)15-12(17)5-4-6-14(15)20-3/h4-9,16H,18H2,1-3H3
InChIKeyUPILCQQOOCJBLP-UHFFFAOYSA-N
XLogP3.20
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.32
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 43626072
(2-chloro-6-fluorophenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 43626075
(2,6-difluorophenyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 43122336
(2,6-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 43122398
(2,6-difluorophenyl)-(2-ethoxy-5-methylphenyl)methanamine
CID 62302991
(3-fluoro-4-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 62505966
1-[chloro-(2-fluoro-6-methoxyphenyl)methyl]-2,4-dimethylbenzene
CID 65432513
(2-chloro-6-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanamine
CID 104545797
(2,5-dibromophenyl)-(2-fluoro-6-methoxyphenyl)methanamine
CID 65433424
(2,6-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 105051988
(2,6-dimethoxyphenyl)-(2,4,5-trifluorophenyl)methanamine
CID 103301943
2-[chloro-(2-fluoro-6-methoxyphenyl)methyl]-4-fluoro-1-methoxybenzene
CID 65434058

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
The IUPAC name of (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine (CID 65434780) is (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine.
What is the SMILES notation for (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
The canonical SMILES for (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine is COc1ccc(C)cc1C(N)c1c(F)cccc1OC.
What is the InChIKey of (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
The InChIKey is UPILCQQOOCJBLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO2/c1-10-7-8-13(19-2)11(9-10)16(18)15-12(17)5-4-6-14(15)20-3/h4-9,16H,18H2,1-3H3.
What are the key properties of (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine?
(2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine has a molecular weight of 275.32 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine is sourced from PubChem (CID 65434780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).