(1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol

C7H10FNOS — CID 135178511

IUPAC(1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol
SMILESNCC[C@H](O)c1ccc(F)s1
InChIInChI=1S/C7H10FNOS/c8-7-2-1-6(11-7)5(10)3-4-9/h1-2,5,10H,3-4,9H2/t5-/m0/s1
InChIKeyNBTQRXPJDUXFFR-YFKPBYRVSA-N
MW175.23 g/mol
LogP1.27
Rot. Bonds3

About (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol

(1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol (PubChem CID 135178511) has the molecular formula C7H10FNOS and a molecular weight of 175.23 g/mol. Its IUPAC name is (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol.

Molecular Properties

Compound Name(1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol
PubChem CID135178511
Molecular FormulaC7H10FNOS
Molecular Weight175.23 g/mol
Exact Mass175.05
IUPAC Name(1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol
SMILESNCC[C@H](O)c1ccc(F)s1
InChIInChI=1S/C7H10FNOS/c8-7-2-1-6(11-7)5(10)3-4-9/h1-2,5,10H,3-4,9H2/t5-/m0/s1
InChIKeyNBTQRXPJDUXFFR-YFKPBYRVSA-N
XLogP1.27
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
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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Related Compounds

(1R)-3-amino-1-[5-(trifluoromethyl)thiophen-2-yl]propan-1-ol
CID 96888684
(3S)-3-amino-3-(5-fluorothiophen-2-yl)propan-1-ol
CID 130898203
2,2,2-trifluoro-1-(5-fluorothiophen-2-yl)ethanol
CID 91927202
1-(5-fluorothiophen-2-yl)ethanamine;hydrochloride
CID 91927262
3-amino-1-(4,5-dibromothiophen-2-yl)propan-1-ol
CID 80538163
(3R)-3-amino-3-(5-fluorothiophen-2-yl)propanoic acid
CID 130682565
3-amino-1-(2,5-difluorophenyl)propan-1-ol
CID 64989517
2-(3-amino-1-hydroxypropyl)-3-fluorobenzene-1,4-diol
CID 84776107
(1R)-3-amino-1-(2,5-difluorophenyl)propan-1-ol
CID 93182256
2-(3-amino-1-hydroxypropyl)-3,4-difluorophenol
CID 84671264
5-(3-amino-1-hydroxypropyl)-2-fluorophenol
CID 84769630
(1R)-3-amino-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propan-1-ol
CID 96777587

Frequently Asked Questions

What is the IUPAC name of (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol?
The IUPAC name of (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol (CID 135178511) is (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol.
What is the SMILES notation for (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol?
The canonical SMILES for (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol is NCC[C@H](O)c1ccc(F)s1.
What is the InChIKey of (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol?
The InChIKey is NBTQRXPJDUXFFR-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H10FNOS/c8-7-2-1-6(11-7)5(10)3-4-9/h1-2,5,10H,3-4,9H2/t5-/m0/s1.
What are the key properties of (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol?
(1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol has a molecular weight of 175.23 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-3-amino-1-(5-fluorothiophen-2-yl)propan-1-ol is sourced from PubChem (CID 135178511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).