1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine

C10H9F2N3S — CID 105149290

IUPAC1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
SMILESCNC(c1csnn1)c1c(F)cccc1F
InChIInChI=1S/C10H9F2N3S/c1-13-10(8-5-16-15-14-8)9-6(11)3-2-4-7(9)12/h2-5,10,13H,1H3
InChIKeyUJTKFTMIMXWSPS-UHFFFAOYSA-N
MW241.27 g/mol
LogP2.13
Rot. Bonds3

About 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine

1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine (PubChem CID 105149290) has the molecular formula C10H9F2N3S and a molecular weight of 241.27 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
PubChem CID105149290
Molecular FormulaC10H9F2N3S
Molecular Weight241.27 g/mol
Exact Mass241.05
IUPAC Name1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
SMILESCNC(c1csnn1)c1c(F)cccc1F
InChIInChI=1S/C10H9F2N3S/c1-13-10(8-5-16-15-14-8)9-6(11)3-2-4-7(9)12/h2-5,10,13H,1H3
InChIKeyUJTKFTMIMXWSPS-UHFFFAOYSA-N
XLogP2.13
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105076130
1-(3-fluoro-4-pyridinyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105181850
1-(2,6-difluorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712535
N-methyl-1-(thiadiazol-4-yl)-1-thiophen-3-ylmethanamine
CID 105153904
1-(1-benzothiophen-7-yl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105172720
1-(2,6-difluorophenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 79522798
1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
CID 43483206
2-(3-fluorophenyl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105095616
1-(2,6-difluorophenyl)-1-(6-methoxypyrimidin-4-yl)-N-methylmethanamine
CID 102951139
1-(2-cyclobutylphenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105188804
2-(3,4-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105175945
N-methyl-1-(3-methyltriazol-4-yl)-1-(thiadiazol-4-yl)methanamine
CID 105184460

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
The IUPAC name of 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine (CID 105149290) is 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine.
What is the SMILES notation for 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
The canonical SMILES for 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine is CNC(c1csnn1)c1c(F)cccc1F.
What is the InChIKey of 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
The InChIKey is UJTKFTMIMXWSPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3S/c1-13-10(8-5-16-15-14-8)9-6(11)3-2-4-7(9)12/h2-5,10,13H,1H3.
What are the key properties of 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine has a molecular weight of 241.27 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine is sourced from PubChem (CID 105149290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).