2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine

C11H11F2N3S — CID 105105424

IUPAC2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
SMILESCNC(Cc1cc(F)ccc1F)c1cnns1
InChIInChI=1S/C11H11F2N3S/c1-14-10(11-6-15-16-17-11)5-7-4-8(12)2-3-9(7)13/h2-4,6,10,14H,5H2,1H3
InChIKeyKTZBUYZDFQDEKP-UHFFFAOYSA-N
MW255.29 g/mol
LogP2.32
Rot. Bonds4

About 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine

2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine (PubChem CID 105105424) has the molecular formula C11H11F2N3S and a molecular weight of 255.29 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
PubChem CID105105424
Molecular FormulaC11H11F2N3S
Molecular Weight255.29 g/mol
Exact Mass255.06
IUPAC Name2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
SMILESCNC(Cc1cc(F)ccc1F)c1cnns1
InChIInChI=1S/C11H11F2N3S/c1-14-10(11-6-15-16-17-11)5-7-4-8(12)2-3-9(7)13/h2-4,6,10,14H,5H2,1H3
InChIKeyKTZBUYZDFQDEKP-UHFFFAOYSA-N
XLogP2.32
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluoro-2-methylphenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
CID 105188368
[2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 105296596
1-(1-benzothiophen-2-yl)-2-(2,5-difluorophenyl)-N-methylethanamine
CID 115810512
2-(2,5-difluorophenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 115809913
2-(5-ethylthiophen-2-yl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
CID 105136127
2-(2,5-difluorophenyl)-1-(3,4-dimethylphenyl)-N-methylethanamine
CID 115809738
1-(3,5-dibromophenyl)-2-(2,5-difluorophenyl)-N-methylethanamine
CID 107973909
1-(4-fluoro-2-methylphenyl)-N-methyl-1-(thiadiazol-5-yl)methanamine
CID 105142882
1-(4-bromo-3-fluorophenyl)-2-(2,5-difluorophenyl)-N-methylethanamine
CID 115809591
[2-(2,5-difluorophenyl)-1-(1,3-thiazol-5-yl)ethyl]hydrazine
CID 105253684
1-(2-chloro-3-fluorophenyl)-2-(2,5-difluorophenyl)-N-methylethanamine
CID 115809397
2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 105087930

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
The IUPAC name of 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine (CID 105105424) is 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine.
What is the SMILES notation for 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
The canonical SMILES for 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine is CNC(Cc1cc(F)ccc1F)c1cnns1.
What is the InChIKey of 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
The InChIKey is KTZBUYZDFQDEKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2N3S/c1-14-10(11-6-15-16-17-11)5-7-4-8(12)2-3-9(7)13/h2-4,6,10,14H,5H2,1H3.
What are the key properties of 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine?
2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine has a molecular weight of 255.29 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine is sourced from PubChem (CID 105105424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).