(2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol

C7H10FNOS — CID 142633970

IUPAC(2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol
SMILESC[C@H](O)C(N)c1ccsc1F
InChIInChI=1S/C7H10FNOS/c1-4(10)6(9)5-2-3-11-7(5)8/h2-4,6,10H,9H2,1H3/t4-,6?/m0/s1
InChIKeyIQHFNBRKIPWENK-VKZKZBKNSA-N
MW175.23 g/mol
LogP1.27
Rot. Bonds2

About (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol

(2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol (PubChem CID 142633970) has the molecular formula C7H10FNOS and a molecular weight of 175.23 g/mol. Its IUPAC name is (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol.

Molecular Properties

Compound Name(2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol
PubChem CID142633970
Molecular FormulaC7H10FNOS
Molecular Weight175.23 g/mol
Exact Mass175.05
IUPAC Name(2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol
SMILESC[C@H](O)C(N)c1ccsc1F
InChIInChI=1S/C7H10FNOS/c1-4(10)6(9)5-2-3-11-7(5)8/h2-4,6,10H,9H2,1H3/t4-,6?/m0/s1
InChIKeyIQHFNBRKIPWENK-VKZKZBKNSA-N
XLogP1.27
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol?
The IUPAC name of (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol (CID 142633970) is (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol.
What is the SMILES notation for (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol?
The canonical SMILES for (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol is C[C@H](O)C(N)c1ccsc1F.
What is the InChIKey of (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol?
The InChIKey is IQHFNBRKIPWENK-VKZKZBKNSA-N. The full InChI is InChI=1S/C7H10FNOS/c1-4(10)6(9)5-2-3-11-7(5)8/h2-4,6,10H,9H2,1H3/t4-,6?/m0/s1.
What are the key properties of (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol?
(2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol has a molecular weight of 175.23 g/mol, XLogP of 1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol is sourced from PubChem (CID 142633970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).