1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine

C17H20FNO — CID 106792082

IUPAC1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)ccc1F)c1ccc(C)cc1OC
InChIInChI=1S/C17H20FNO/c1-11-6-8-15(18)14(9-11)17(19-3)13-7-5-12(2)10-16(13)20-4/h5-10,17,19H,1-4H3
InChIKeyNIAANBKTFSHAMA-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.76
Rot. Bonds4

About 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine

1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine (PubChem CID 106792082) has the molecular formula C17H20FNO and a molecular weight of 273.35 g/mol. Its IUPAC name is 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine
PubChem CID106792082
Molecular FormulaC17H20FNO
Molecular Weight273.35 g/mol
Exact Mass273.15
IUPAC Name1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)ccc1F)c1ccc(C)cc1OC
InChIInChI=1S/C17H20FNO/c1-11-6-8-15(18)14(9-11)17(19-3)13-7-5-12(2)10-16(13)20-4/h5-10,17,19H,1-4H3
InChIKeyNIAANBKTFSHAMA-UHFFFAOYSA-N
XLogP3.76
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluoro-5-methylphenyl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 62790144
1-(4-chloro-2-fluorophenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine
CID 106791779
1-(2-bromo-5-methylphenyl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 115852683
1-(2-methoxy-4-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 106792109
1-(4-chloro-2-fluorophenyl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 55180207
1-(4-bromo-2-methoxyphenyl)-1-(2,5-difluorophenyl)-N-methylmethanamine
CID 115368888
1-(2-methoxy-4-methylphenyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
CID 106792054
1-(4-bromo-2-fluorophenyl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 114906492
1-(4-chloro-2-methoxyphenyl)-1-(2,3-difluoro-4-methylphenyl)-N-methylmethanamine
CID 107513966
1-(2,6-dimethyl-3-pyridinyl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 105143162
1-(2,4-dimethoxyphenyl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 43482669
1-(2-fluoro-4-methylphenyl)-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine
CID 106682218

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine (CID 106792082) is 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine is CNC(c1cc(C)ccc1F)c1ccc(C)cc1OC.
What is the InChIKey of 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine?
The InChIKey is NIAANBKTFSHAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO/c1-11-6-8-15(18)14(9-11)17(19-3)13-7-5-12(2)10-16(13)20-4/h5-10,17,19H,1-4H3.
What are the key properties of 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine?
1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine has a molecular weight of 273.35 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-5-methylphenyl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 106792082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).