(2R)-2-fluoro-3-phenylpropan-1-amine

C9H12FN — CID 69274217

IUPAC(2R)-2-fluoro-3-phenylpropan-1-amine
SMILESNC[C@H](F)Cc1ccccc1
InChIInChI=1S/C9H12FN/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2/t9-/m1/s1
InChIKeyKZJGAIPOKXGDIA-SECBINFHSA-N
MW153.20 g/mol
LogP1.53
Rot. Bonds3

About (2R)-2-fluoro-3-phenylpropan-1-amine

(2R)-2-fluoro-3-phenylpropan-1-amine (PubChem CID 69274217) has the molecular formula C9H12FN and a molecular weight of 153.20 g/mol. Its IUPAC name is (2R)-2-fluoro-3-phenylpropan-1-amine.

Molecular Properties

Compound Name(2R)-2-fluoro-3-phenylpropan-1-amine
PubChem CID69274217
Molecular FormulaC9H12FN
Molecular Weight153.20 g/mol
Exact Mass153.10
IUPAC Name(2R)-2-fluoro-3-phenylpropan-1-amine
SMILESNC[C@H](F)Cc1ccccc1
InChIInChI=1S/C9H12FN/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2/t9-/m1/s1
InChIKeyKZJGAIPOKXGDIA-SECBINFHSA-N
XLogP1.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.20
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-5-phenylpentan-1-amine
CID 83855308
(2S)-2-fluoro-3-(4-methylphenyl)propan-1-amine
CID 129393015
(1R)-1-fluoro-2-phenylethanol
CID 163366132
2-benzyl-3-phenylpropan-1-amine;hydrochloride
CID 75481010
2-fluoro-3-(4-methoxyphenyl)propan-1-amine
CID 84718779
2-methyl-3-phenylpropan-1-amine
CID 12672558
1,1-difluoro-3-phenylpropan-2-ol
CID 15085378
(2R)-N,N-dibenzyl-2-fluoro-3-phenylpropan-1-amine
CID 122216645
3,4-diamino-1-phenylbutan-2-ol
CID 66646271
(2S)-N-benzyl-2-(18F)fluoro-3-phenylpropan-1-amine
CID 177481068
[(2R)-2-fluoro-2-iodoethyl]benzene
CID 124672761
(2S)-3-(2-chlorophenyl)-2-fluoropropan-1-amine
CID 129393023

Frequently Asked Questions

What is the IUPAC name of (2R)-2-fluoro-3-phenylpropan-1-amine?
The IUPAC name of (2R)-2-fluoro-3-phenylpropan-1-amine (CID 69274217) is (2R)-2-fluoro-3-phenylpropan-1-amine.
What is the SMILES notation for (2R)-2-fluoro-3-phenylpropan-1-amine?
The canonical SMILES for (2R)-2-fluoro-3-phenylpropan-1-amine is NC[C@H](F)Cc1ccccc1.
What is the InChIKey of (2R)-2-fluoro-3-phenylpropan-1-amine?
The InChIKey is KZJGAIPOKXGDIA-SECBINFHSA-N. The full InChI is InChI=1S/C9H12FN/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2/t9-/m1/s1.
What are the key properties of (2R)-2-fluoro-3-phenylpropan-1-amine?
(2R)-2-fluoro-3-phenylpropan-1-amine has a molecular weight of 153.20 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-fluoro-3-phenylpropan-1-amine is sourced from PubChem (CID 69274217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).