2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine

C19H24FN — CID 116544108

IUPAC2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine
SMILESCNC(Cc1ccccc1F)c1cccc(CC(C)C)c1
InChIInChI=1S/C19H24FN/c1-14(2)11-15-7-6-9-17(12-15)19(21-3)13-16-8-4-5-10-18(16)20/h4-10,12,14,19,21H,11,13H2,1-3H3
InChIKeyTVGXLLQRJNFIOV-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.53
Rot. Bonds6

About 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine

2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine (PubChem CID 116544108) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine
PubChem CID116544108
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC Name2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine
SMILESCNC(Cc1ccccc1F)c1cccc(CC(C)C)c1
InChIInChI=1S/C19H24FN/c1-14(2)11-15-7-6-9-17(12-15)19(21-3)13-16-8-4-5-10-18(16)20/h4-10,12,14,19,21H,11,13H2,1-3H3
InChIKeyTVGXLLQRJNFIOV-UHFFFAOYSA-N
XLogP4.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-fluorophenyl)-1-(3-fluorophenyl)-N-methylethanamine
CID 54945904
1-(3,4-difluorophenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 43484603
1-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]methanamine
CID 116544288
N-methyl-1-[3-(2-methylpropyl)phenyl]butan-1-amine
CID 116544032
1-(3-chloro-4-methylphenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 63195375
2-(2-chloro-3-fluorophenyl)-N-methyl-1-phenylethanamine
CID 112653601
N-methyl-1-[3-(2-methylpropyl)phenyl]heptan-1-amine
CID 105050603
2-(2-fluorophenyl)-N-methyl-1-(2,4,5-trifluorophenyl)ethanamine
CID 103302394
2-(2-fluorophenyl)-N-methyl-1-thiophen-3-ylethanamine
CID 60820385
[(2-fluorophenyl)-[3-(2-methylpropyl)phenyl]methyl]hydrazine
CID 105216968
2-(2,3-difluorophenyl)-1-(3-methoxyphenyl)-N-methylethanamine
CID 62606417
1-(3-fluoro-4-methylphenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]methanamine
CID 116544023

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine?
The IUPAC name of 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine (CID 116544108) is 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine.
What is the SMILES notation for 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine?
The canonical SMILES for 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine is CNC(Cc1ccccc1F)c1cccc(CC(C)C)c1.
What is the InChIKey of 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine?
The InChIKey is TVGXLLQRJNFIOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-14(2)11-15-7-6-9-17(12-15)19(21-3)13-16-8-4-5-10-18(16)20/h4-10,12,14,19,21H,11,13H2,1-3H3.
What are the key properties of 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine?
2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine has a molecular weight of 285.41 g/mol, XLogP of 4.53, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-methyl-1-[3-(2-methylpropyl)phenyl]ethanamine is sourced from PubChem (CID 116544108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).