(5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine

C8H7FN4S — CID 105102336

IUPAC(5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine
SMILESNC(c1cncc(F)c1)c1cnsn1
InChIInChI=1S/C8H7FN4S/c9-6-1-5(2-11-3-6)8(10)7-4-12-14-13-7/h1-4,8H,10H2
InChIKeyQUCBFMBGKOTTHF-UHFFFAOYSA-N
MW210.24 g/mol
LogP1.12
Rot. Bonds2

About (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine

(5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine (PubChem CID 105102336) has the molecular formula C8H7FN4S and a molecular weight of 210.24 g/mol. Its IUPAC name is (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine.

Molecular Properties

Compound Name(5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine
PubChem CID105102336
Molecular FormulaC8H7FN4S
Molecular Weight210.24 g/mol
Exact Mass210.04
IUPAC Name(5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine
SMILESNC(c1cncc(F)c1)c1cnsn1
InChIInChI=1S/C8H7FN4S/c9-6-1-5(2-11-3-6)8(10)7-4-12-14-13-7/h1-4,8H,10H2
InChIKeyQUCBFMBGKOTTHF-UHFFFAOYSA-N
XLogP1.12
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(5-ethoxy-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine
CID 105175526
(4-chlorophenyl)-(1,2,5-thiadiazol-3-yl)methanamine
CID 105076381
(2-bromo-5-iodophenyl)-(5-fluoro-3-pyridinyl)methanamine
CID 114026972
(6-methyl-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine
CID 105146258
1,2,5-thiadiazol-3-yl-(2,3,4-trifluorophenyl)methanamine
CID 105146497
(3-chloro-4-methylthiophen-2-yl)-(5-fluoro-3-pyridinyl)methanamine
CID 103405312
(3,5-dichloro-2-pyridinyl)-(5-fluoro-3-pyridinyl)methanamine
CID 79780714
methyl 2-amino-2-(5-fluoro-3-pyridinyl)acetate
CID 131354218
(3-methyl-1,2-thiazol-5-yl)-(1,2,5-thiadiazol-3-yl)methanamine
CID 126985760
(5-fluoro-3-pyridinyl)-(4-propylthiadiazol-5-yl)methanamine
CID 105102650
(5-fluoro-3-pyridinyl)-(4-methylsulfonylphenyl)methanamine
CID 115804928
(5-fluoro-3-pyridinyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 115804926

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine?
The IUPAC name of (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine (CID 105102336) is (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine.
What is the SMILES notation for (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine?
The canonical SMILES for (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine is NC(c1cncc(F)c1)c1cnsn1.
What is the InChIKey of (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine?
The InChIKey is QUCBFMBGKOTTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN4S/c9-6-1-5(2-11-3-6)8(10)7-4-12-14-13-7/h1-4,8H,10H2.
What are the key properties of (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine?
(5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine has a molecular weight of 210.24 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine is sourced from PubChem (CID 105102336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).