2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine

C15H14ClF2N — CID 103048641

IUPAC2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine
SMILESCNC(Cc1cc(Cl)ccc1F)c1ccccc1F
InChIInChI=1S/C15H14ClF2N/c1-19-15(12-4-2-3-5-14(12)18)9-10-8-11(16)6-7-13(10)17/h2-8,15,19H,9H2,1H3
InChIKeyYYHYCMNRIJGEMM-UHFFFAOYSA-N
MW281.73 g/mol
LogP4.12
Rot. Bonds4

About 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine

2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine (PubChem CID 103048641) has the molecular formula C15H14ClF2N and a molecular weight of 281.73 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine
PubChem CID103048641
Molecular FormulaC15H14ClF2N
Molecular Weight281.73 g/mol
Exact Mass281.08
IUPAC Name2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine
SMILESCNC(Cc1cc(Cl)ccc1F)c1ccccc1F
InChIInChI=1S/C15H14ClF2N/c1-19-15(12-4-2-3-5-14(12)18)9-10-8-11(16)6-7-13(10)17/h2-8,15,19H,9H2,1H3
InChIKeyYYHYCMNRIJGEMM-UHFFFAOYSA-N
XLogP4.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.73
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-chloro-2-fluorophenyl)-1-(2-chlorophenyl)-N-methylethanamine
CID 103048581
1-(5-chloro-2-fluorophenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 61066303
1-(4-chloro-2-fluorophenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 61066122
2-(5-chloro-2-fluorophenyl)-1-(2-fluoro-5-methylphenyl)-N-methylethanamine
CID 103052743
2-(5-chloro-2-fluorophenyl)-1-(2,4-difluoro-5-methylphenyl)-N-methylethanamine
CID 103053283
1-(2-chloro-3-fluorophenyl)-2-(2,5-difluorophenyl)-N-methylethanamine
CID 115809397
1-(2-bromo-4-chlorophenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 107988832
1-(2-bromofuran-3-yl)-2-(5-chloro-2-fluorophenyl)-N-methylethanamine
CID 106858959
1-(2-bromo-3,4-difluorophenyl)-2-(5-chloro-2-fluorophenyl)-N-methylethanamine
CID 107539105
2-(2-chloro-3-fluorophenyl)-1-(4-chloro-2-fluorophenyl)-N-methylethanamine
CID 115983761
2-(5-chloro-2-fluorophenyl)-1-(3-fluoro-2-pyridinyl)-N-methylethanamine
CID 103049000
2-(5-chloro-2-fluorophenyl)-1-(2,4-dibromophenyl)-N-methylethanamine
CID 107947073

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine (CID 103048641) is 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine is CNC(Cc1cc(Cl)ccc1F)c1ccccc1F.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine?
The InChIKey is YYHYCMNRIJGEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClF2N/c1-19-15(12-4-2-3-5-14(12)18)9-10-8-11(16)6-7-13(10)17/h2-8,15,19H,9H2,1H3.
What are the key properties of 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine?
2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine has a molecular weight of 281.73 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylethanamine is sourced from PubChem (CID 103048641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).