2-imidazol-1-yl-5-methyl-1,3-thiazole

C7H7N3S — CID 59693976

IUPAC2-imidazol-1-yl-5-methyl-1,3-thiazole
SMILESCc1cnc(-n2ccnc2)s1
InChIInChI=1S/C7H7N3S/c1-6-4-9-7(11-6)10-3-2-8-5-10/h2-5H,1H3
InChIKeyGQPNYKZGIQRKLS-UHFFFAOYSA-N
MW165.22 g/mol
LogP1.64
Rot. Bonds1

About 2-imidazol-1-yl-5-methyl-1,3-thiazole

2-imidazol-1-yl-5-methyl-1,3-thiazole (PubChem CID 59693976) has the molecular formula C7H7N3S and a molecular weight of 165.22 g/mol. Its IUPAC name is 2-imidazol-1-yl-5-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-imidazol-1-yl-5-methyl-1,3-thiazole
PubChem CID59693976
Molecular FormulaC7H7N3S
Molecular Weight165.22 g/mol
Exact Mass165.04
IUPAC Name2-imidazol-1-yl-5-methyl-1,3-thiazole
SMILESCc1cnc(-n2ccnc2)s1
InChIInChI=1S/C7H7N3S/c1-6-4-9-7(11-6)10-3-2-8-5-10/h2-5H,1H3
InChIKeyGQPNYKZGIQRKLS-UHFFFAOYSA-N
XLogP1.64
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-imidazol-1-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
CID 66521304
5-methyl-2-(1,2,4-triazol-1-yl)-1,3-thiazole
CID 58458813
2-imidazol-1-yl-4-methyl-1,3-thiazole-5-carboxylic acid
CID 51048808
5-methyl-2-(4-nitroimidazol-1-yl)-1,3-thiazole
CID 101439992
N-(2-imidazol-1-yl-1,3-thiazol-5-yl)pyrimidine-4-carboxamide
CID 166095146
4,5-dibromo-2-imidazol-1-yl-1,3-thiazole
CID 66521025
2-ethyl-5-imidazol-1-ylpyrazine
CID 59059029
N-(2-imidazol-1-ylethyl)-5-methyl-1,3-thiazol-2-amine
CID 130782234
6-ethyl-4-imidazol-1-ylthieno[2,3-d]pyrimidine
CID 47021451
6-imidazol-1-yl-N-[1-(5-methylthiophen-2-yl)ethyl]pyridin-3-amine
CID 43710648
6-imidazol-1-yl-5-methylpyridin-3-amine
CID 62475908
4-chloro-2-imidazol-1-yl-1,3-benzothiazole
CID 141304717

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-5-methyl-1,3-thiazole?
The IUPAC name of 2-imidazol-1-yl-5-methyl-1,3-thiazole (CID 59693976) is 2-imidazol-1-yl-5-methyl-1,3-thiazole.
What is the SMILES notation for 2-imidazol-1-yl-5-methyl-1,3-thiazole?
The canonical SMILES for 2-imidazol-1-yl-5-methyl-1,3-thiazole is Cc1cnc(-n2ccnc2)s1.
What is the InChIKey of 2-imidazol-1-yl-5-methyl-1,3-thiazole?
The InChIKey is GQPNYKZGIQRKLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S/c1-6-4-9-7(11-6)10-3-2-8-5-10/h2-5H,1H3.
What are the key properties of 2-imidazol-1-yl-5-methyl-1,3-thiazole?
2-imidazol-1-yl-5-methyl-1,3-thiazole has a molecular weight of 165.22 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-5-methyl-1,3-thiazole is sourced from PubChem (CID 59693976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).