2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine

C10H10FN3S — CID 105087109

IUPAC2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine
SMILESNC(Cc1ccc(F)cc1)c1cnns1
InChIInChI=1S/C10H10FN3S/c11-8-3-1-7(2-4-8)5-9(12)10-6-13-14-15-10/h1-4,6,9H,5,12H2
InChIKeyBNHAEFZXELAMLI-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.92
Rot. Bonds3

About 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine

2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine (PubChem CID 105087109) has the molecular formula C10H10FN3S and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine
PubChem CID105087109
Molecular FormulaC10H10FN3S
Molecular Weight223.28 g/mol
Exact Mass223.06
IUPAC Name2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine
SMILESNC(Cc1ccc(F)cc1)c1cnns1
InChIInChI=1S/C10H10FN3S/c11-8-3-1-7(2-4-8)5-9(12)10-6-13-14-15-10/h1-4,6,9H,5,12H2
InChIKeyBNHAEFZXELAMLI-UHFFFAOYSA-N
XLogP1.92
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-bromo-5-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine
CID 105169436
N-[2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethyl]propan-1-amine
CID 105087093
2-(2-fluoro-3-methoxyphenyl)-1-(thiadiazol-5-yl)ethanamine
CID 105180643
2-(3-chloro-2-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine
CID 102866724
(1R)-1,2-bis(4-fluorophenyl)ethanamine
CID 42058912
2-(2,5-dimethylphenyl)-1-(thiadiazol-5-yl)ethanamine
CID 105101119
2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(thiadiazol-5-yl)ethanamine
CID 105171790
[2-(4-methylphenyl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 105284186
(1S)-2-(4-fluorophenyl)-1-pyridin-3-ylethanamine
CID 93422741
N-[(2R)-3-amino-2-[(4-fluorophenyl)methyl]-3-oxopropyl]thiadiazole-5-carboxamide
CID 95136790
1-(4-fluoro-3,5-dimethylphenyl)-2-(4-fluorophenyl)ethanamine
CID 65298904
[2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 105296596

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine?
The IUPAC name of 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine (CID 105087109) is 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine?
The canonical SMILES for 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine is NC(Cc1ccc(F)cc1)c1cnns1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine?
The InChIKey is BNHAEFZXELAMLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3S/c11-8-3-1-7(2-4-8)5-9(12)10-6-13-14-15-10/h1-4,6,9H,5,12H2.
What are the key properties of 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine?
2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine has a molecular weight of 223.28 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethanamine is sourced from PubChem (CID 105087109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).