2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine

C15H15F2N — CID 20642648

IUPAC2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine
SMILESNCCc1cccc(F)c1Cc1ccccc1F
InChIInChI=1S/C15H15F2N/c16-14-6-2-1-4-12(14)10-13-11(8-9-18)5-3-7-15(13)17/h1-7H,8-10,18H2
InChIKeyVXBHQHCQOSORJL-UHFFFAOYSA-N
MW247.29 g/mol
LogP3.06
Rot. Bonds4

About 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine

2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine (PubChem CID 20642648) has the molecular formula C15H15F2N and a molecular weight of 247.29 g/mol. Its IUPAC name is 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine.

Molecular Properties

Compound Name2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine
PubChem CID20642648
Molecular FormulaC15H15F2N
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC Name2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine
SMILESNCCc1cccc(F)c1Cc1ccccc1F
InChIInChI=1S/C15H15F2N/c16-14-6-2-1-4-12(14)10-13-11(8-9-18)5-3-7-15(13)17/h1-7H,8-10,18H2
InChIKeyVXBHQHCQOSORJL-UHFFFAOYSA-N
XLogP3.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 21497428
2-[3-fluoro-2-(trifluoromethyl)phenyl]ethanamine
CID 84674830
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CID 15013079
2-(2-bromo-6-fluorophenyl)ethanamine
CID 83384131
2-[2-(2-fluorophenoxy)phenyl]ethanamine
CID 63817709
2-[2-[(2-fluorophenyl)methoxy]-3-methylphenyl]ethanamine
CID 112614778
CID 160803924
CID 160803924
2-[3-(2-aminoethyl)-2-bromophenyl]ethanamine
CID 170868655
(2,3-difluorophenyl)methanamine
CID 2736941
3-[3-[(2-fluorophenyl)methyl]-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 16767692
5-(2-fluorophenyl)pent-3-en-1-amine
CID 79590269
2-[2-fluoro-6-(trifluoromethyl)phenyl]ethanamine
CID 53403533

Frequently Asked Questions

What is the IUPAC name of 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine?
The IUPAC name of 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine (CID 20642648) is 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine.
What is the SMILES notation for 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine?
The canonical SMILES for 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine is NCCc1cccc(F)c1Cc1ccccc1F.
What is the InChIKey of 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine?
The InChIKey is VXBHQHCQOSORJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N/c16-14-6-2-1-4-12(14)10-13-11(8-9-18)5-3-7-15(13)17/h1-7H,8-10,18H2.
What are the key properties of 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine?
2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine has a molecular weight of 247.29 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-fluoro-2-[(2-fluorophenyl)methyl]phenyl]ethanamine is sourced from PubChem (CID 20642648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).