N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine

C10H13N3S2 — CID 105166473

IUPACN-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine
SMILESCNC(c1sccc1C)c1snnc1C
InChIInChI=1S/C10H13N3S2/c1-6-4-5-14-9(6)8(11-3)10-7(2)12-13-15-10/h4-5,8,11H,1-3H3
InChIKeyYGRXWWFNTBSPLU-UHFFFAOYSA-N
MW239.37 g/mol
LogP2.53
Rot. Bonds3

About N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine

N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine (PubChem CID 105166473) has the molecular formula C10H13N3S2 and a molecular weight of 239.37 g/mol. Its IUPAC name is N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine
PubChem CID105166473
Molecular FormulaC10H13N3S2
Molecular Weight239.37 g/mol
Exact Mass239.06
IUPAC NameN-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine
SMILESCNC(c1sccc1C)c1snnc1C
InChIInChI=1S/C10H13N3S2/c1-6-4-5-14-9(6)8(11-3)10-7(2)12-13-15-10/h4-5,8,11H,1-3H3
InChIKeyYGRXWWFNTBSPLU-UHFFFAOYSA-N
XLogP2.53
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(4-methylthiadiazol-5-yl)-1-(2-methylthiophen-3-yl)methanamine
CID 102841311
N-methyl-1-(3-methylthiophen-2-yl)-1-(1,3-thiazol-2-yl)methanamine
CID 61346189
N-methyl-1-(2-methylthiophen-3-yl)-1-(3-methylthiophen-2-yl)methanamine
CID 102841226
1-(4-chlorophenyl)-N-methyl-1-(4-methylthiadiazol-5-yl)methanamine
CID 105076322
[(4-methylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102843321
N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine
CID 79987622
1-(5-ethylfuran-2-yl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 62345160
N-methyl-1-(3-methylthiophen-2-yl)-1-(1H-pyrazol-4-yl)methanamine
CID 82237954
1-(4,5-dimethylthiophen-2-yl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 65237462
1-(4-tert-butylphenyl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 43484390
N-methyl-1-(2-methylnaphthalen-1-yl)-1-(3-methylthiophen-2-yl)methanamine
CID 81431713
1-(3-bromothiophen-2-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
CID 105173067

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine?
The IUPAC name of N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine (CID 105166473) is N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine is CNC(c1sccc1C)c1snnc1C.
What is the InChIKey of N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine?
The InChIKey is YGRXWWFNTBSPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S2/c1-6-4-5-14-9(6)8(11-3)10-7(2)12-13-15-10/h4-5,8,11H,1-3H3.
What are the key properties of N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine?
N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine has a molecular weight of 239.37 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methylthiadiazol-5-yl)-1-(3-methylthiophen-2-yl)methanamine is sourced from PubChem (CID 105166473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).