(1R,2R)-2-fluoro-1,2-diphenylethanamine

C14H14FN — CID 12617058

IUPAC(1R,2R)-2-fluoro-1,2-diphenylethanamine
SMILESN[C@H](c1ccccc1)[C@H](F)c1ccccc1
InChIInChI=1S/C14H14FN/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H,16H2/t13-,14-/m1/s1
InChIKeyPSMWLVKGJRNYQC-ZIAGYGMSSA-N
MW215.27 g/mol
LogP3.40
Rot. Bonds3

About (1R,2R)-2-fluoro-1,2-diphenylethanamine

(1R,2R)-2-fluoro-1,2-diphenylethanamine (PubChem CID 12617058) has the molecular formula C14H14FN and a molecular weight of 215.27 g/mol. Its IUPAC name is (1R,2R)-2-fluoro-1,2-diphenylethanamine.

Molecular Properties

Compound Name(1R,2R)-2-fluoro-1,2-diphenylethanamine
PubChem CID12617058
Molecular FormulaC14H14FN
Molecular Weight215.27 g/mol
Exact Mass215.11
IUPAC Name(1R,2R)-2-fluoro-1,2-diphenylethanamine
SMILESN[C@H](c1ccccc1)[C@H](F)c1ccccc1
InChIInChI=1S/C14H14FN/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H,16H2/t13-,14-/m1/s1
InChIKeyPSMWLVKGJRNYQC-ZIAGYGMSSA-N
XLogP3.40
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.27
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,3-triphenylpropane-1,3-diamine
CID 67052848
(1,3-difluoro-1,3-diphenylpropan-2-yl)benzene
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(2R,3R)-2-amino-3-fluoro-3-phenylpropanoic acid
CID 23234194
(2R,3R)-2-amino-3-fluoro-3-phenylpropanamide
CID 13182012
(1S,2R)-1-phenylbutane-1,2-diamine
CID 10702186
(1S,2R)-2-amino-1,2-diphenylethanol
CID 719822
(1R,2S)-2-(15N)azanyl-1,2-diphenylethanol
CID 11745978
[fluoro(fluoro)methyl]benzene
CID 146164458
2-amino-1-cyclopropyl-2-phenylethanol
CID 62720038
(1R,2R)-2-amino-1,2-diphenylethanol;hydrochloride
CID 145453159
2-hydrazinyl-1,2-diphenylethanamine
CID 143003712
(1S,2S)-2-N-methyl-1-phenylpropane-1,2-diamine
CID 6711442

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-2-fluoro-1,2-diphenylethanamine?
The IUPAC name of (1R,2R)-2-fluoro-1,2-diphenylethanamine (CID 12617058) is (1R,2R)-2-fluoro-1,2-diphenylethanamine.
What is the SMILES notation for (1R,2R)-2-fluoro-1,2-diphenylethanamine?
The canonical SMILES for (1R,2R)-2-fluoro-1,2-diphenylethanamine is N[C@H](c1ccccc1)[C@H](F)c1ccccc1.
What is the InChIKey of (1R,2R)-2-fluoro-1,2-diphenylethanamine?
The InChIKey is PSMWLVKGJRNYQC-ZIAGYGMSSA-N. The full InChI is InChI=1S/C14H14FN/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H,16H2/t13-,14-/m1/s1.
What are the key properties of (1R,2R)-2-fluoro-1,2-diphenylethanamine?
(1R,2R)-2-fluoro-1,2-diphenylethanamine has a molecular weight of 215.27 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-2-fluoro-1,2-diphenylethanamine is sourced from PubChem (CID 12617058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).