5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine

C10H16N4S — CID 79510628

IUPAC5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine
SMILESCCCN1C(N)=NCC1(C)c1nccs1
InChIInChI=1S/C10H16N4S/c1-3-5-14-9(11)13-7-10(14,2)8-12-4-6-15-8/h4,6H,3,5,7H2,1-2H3,(H2,11,13)
InChIKeyLEPOHMKDHYSBTI-UHFFFAOYSA-N
MW224.33 g/mol
LogP1.40
Rot. Bonds3

About 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine

5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine (PubChem CID 79510628) has the molecular formula C10H16N4S and a molecular weight of 224.33 g/mol. Its IUPAC name is 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine
PubChem CID79510628
Molecular FormulaC10H16N4S
Molecular Weight224.33 g/mol
Exact Mass224.11
IUPAC Name5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine
SMILESCCCN1C(N)=NCC1(C)c1nccs1
InChIInChI=1S/C10H16N4S/c1-3-5-14-9(11)13-7-10(14,2)8-12-4-6-15-8/h4,6H,3,5,7H2,1-2H3,(H2,11,13)
InChIKeyLEPOHMKDHYSBTI-UHFFFAOYSA-N
XLogP1.40
TPSA54.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1,3-Thiazol-2-yl)propan-2-amine
CID 28286203
2-Methyl-1-[3-(1,3-thiazol-2-yl)propyl]guanidine;hydroiodide
CID 13499390
2-Methyl-1-[3-(1,3-thiazol-2-yl)propyl]guanidine
CID 13499389
2-Cyano-1-methyl-1-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]guanidine
CID 19373026
1-Cyano-2-methyl-1-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]guanidine
CID 19373027
2-Cyano-1-[2-(dimethylamino)ethyl]-1-[2-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]guanidine
CID 20567435
2-Methyl-1-[2-(1,3-thiazol-2-ylmethylamino)ethyl]guanidine
CID 20567777
2-Cyano-1-methyl-1-[3-(1,3-thiazol-2-ylmethylamino)propyl]guanidine
CID 23337134
1-Cyano-3-[2-(dimethylamino)ethyl]-2-[2-(1,3-thiazol-2-ylmethylamino)ethyl]guanidine
CID 53721364
1-Cyano-2-methyl-3-[3-(1,3-thiazol-2-ylmethylamino)propyl]guanidine
CID 54275032
2-(2-Ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole
CID 54560328
2-[1-Methylsulfanyl-1-(1,3-thiazol-2-yl)ethyl]guanidine
CID 57003616

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine?
The IUPAC name of 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine (CID 79510628) is 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine.
What is the SMILES notation for 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine?
The canonical SMILES for 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine is CCCN1C(N)=NCC1(C)c1nccs1.
What is the InChIKey of 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine?
The InChIKey is LEPOHMKDHYSBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4S/c1-3-5-14-9(11)13-7-10(14,2)8-12-4-6-15-8/h4,6H,3,5,7H2,1-2H3,(H2,11,13).
What are the key properties of 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine?
5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine has a molecular weight of 224.33 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-propyl-5-(1,3-thiazol-2-yl)-4H-imidazol-2-amine is sourced from PubChem (CID 79510628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).