1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine

C11H17N5S — CID 114283539

IUPAC1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
SMILESCCc1nnsc1C(NC)c1cnc(C)n1C
InChIInChI=1S/C11H17N5S/c1-5-8-11(17-15-14-8)10(12-3)9-6-13-7(2)16(9)4/h6,10,12H,5H2,1-4H3
InChIKeyBZNHBOUUSZCALK-UHFFFAOYSA-N
MW251.36 g/mol
LogP1.45
Rot. Bonds4

About 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine

1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine (PubChem CID 114283539) has the molecular formula C11H17N5S and a molecular weight of 251.36 g/mol. Its IUPAC name is 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
PubChem CID114283539
Molecular FormulaC11H17N5S
Molecular Weight251.36 g/mol
Exact Mass251.12
IUPAC Name1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
SMILESCCc1nnsc1C(NC)c1cnc(C)n1C
InChIInChI=1S/C11H17N5S/c1-5-8-11(17-15-14-8)10(12-3)9-6-13-7(2)16(9)4/h6,10,12H,5H2,1-4H3
InChIKeyBZNHBOUUSZCALK-UHFFFAOYSA-N
XLogP1.45
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.36
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(3,5-dimethylphenyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105096803
1-(4-ethylthiadiazol-5-yl)-N-methyl-1-quinolin-3-ylmethanamine
CID 105097449
[(1-ethylimidazol-2-yl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105308543
1-(4-bromophenyl)-1-(2,3-dimethylimidazol-4-yl)-N-methylmethanamine
CID 114283396
1-(3,5-dimethoxyphenyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105168316
1-(4-ethylthiadiazol-5-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylmethanamine
CID 105186785
[(4-ethylthiadiazol-5-yl)-pyrazin-2-ylmethyl]hydrazine
CID 105308737
1-(4-ethylthiadiazol-5-yl)-N-methyl-1-(2-methylquinolin-6-yl)methanamine
CID 105172229
N-[(4-ethylthiadiazol-5-yl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 105146355
1-(4-ethylthiadiazol-5-yl)-N-methyl-1-(4-propan-2-yloxyphenyl)methanamine
CID 105144640
1-(2,3-dimethylimidazol-4-yl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 114283414
[(4-ethylthiadiazol-5-yl)-(3-methoxypyrazin-2-yl)methyl]hydrazine
CID 105332698

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine (CID 114283539) is 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine is CCc1nnsc1C(NC)c1cnc(C)n1C.
What is the InChIKey of 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
The InChIKey is BZNHBOUUSZCALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5S/c1-5-8-11(17-15-14-8)10(12-3)9-6-13-7(2)16(9)4/h6,10,12H,5H2,1-4H3.
What are the key properties of 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine?
1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine has a molecular weight of 251.36 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylimidazol-4-yl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine is sourced from PubChem (CID 114283539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).