N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine

C7H9N5S — CID 130703189

IUPACN-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2cnnn2C)cs1
InChIInChI=1S/C7H9N5S/c1-8-7-10-5(4-13-7)6-3-9-11-12(6)2/h3-4H,1-2H3,(H,8,10)
InChIKeyYDEYKYXWGBINEI-UHFFFAOYSA-N
MW195.25 g/mol
LogP0.98
Rot. Bonds2

About N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine

N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine (PubChem CID 130703189) has the molecular formula C7H9N5S and a molecular weight of 195.25 g/mol. Its IUPAC name is N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine
PubChem CID130703189
Molecular FormulaC7H9N5S
Molecular Weight195.25 g/mol
Exact Mass195.06
IUPAC NameN-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2cnnn2C)cs1
InChIInChI=1S/C7H9N5S/c1-8-7-10-5(4-13-7)6-3-9-11-12(6)2/h3-4H,1-2H3,(H,8,10)
InChIKeyYDEYKYXWGBINEI-UHFFFAOYSA-N
XLogP0.98
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.25
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,6-dimethyl-4-[2-(methylamino)-1,3-thiazol-4-yl]pyridazin-3-one
CID 82442682
N-methyl-4-(5-methyl-1H-pyrazol-4-yl)-1,3-thiazol-2-amine
CID 59363535
N-methyl-4-(5-methyl-3-pyridinyl)-1,3-thiazol-2-amine
CID 86806465
N-methyl-4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-amine
CID 60642187
N-methyl-4-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]-1,3-thiazol-2-amine
CID 82425351
4-(3-isocyano-1-methylpyrazol-4-yl)-N-methyl-1,3-thiazol-2-amine
CID 58477483
N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine
CID 8963026
4-(1H-benzimidazol-2-yl)-N-methyl-1,3-thiazol-2-amine
CID 14668556
N-methyl-4-(4-pyrrolidin-1-ylphenyl)-1,3-thiazol-2-amine
CID 59088623
4-(1,2-dimethylbenzimidazol-5-yl)-N-methyl-1,3-thiazol-2-amine
CID 82500092
4-[1-(2-chlorophenyl)-5-methylpyrazol-4-yl]-N-methyl-1,3-thiazol-2-amine
CID 82528304
4-[1-(2,5-dimethylphenyl)-5-methylpyrazol-4-yl]-N-methyl-1,3-thiazol-2-amine
CID 82528526

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine (CID 130703189) is N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine is CNc1nc(-c2cnnn2C)cs1.
What is the InChIKey of N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine?
The InChIKey is YDEYKYXWGBINEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5S/c1-8-7-10-5(4-13-7)6-3-9-11-12(6)2/h3-4H,1-2H3,(H,8,10).
What are the key properties of N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine?
N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine has a molecular weight of 195.25 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(3-methyltriazol-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 130703189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).