4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine

C10H11N3S — CID 141114690

IUPAC4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine
SMILESCCSc1ncc(-c2ccncc2)[nH]1
InChIInChI=1S/C10H11N3S/c1-2-14-10-12-7-9(13-10)8-3-5-11-6-4-8/h3-7H,2H2,1H3,(H,12,13)
InChIKeyHJNWBHLGVFSMIJ-UHFFFAOYSA-N
MW205.29 g/mol
LogP2.58
Rot. Bonds3

About 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine

4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine (PubChem CID 141114690) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine.

Molecular Properties

Compound Name4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine
PubChem CID141114690
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine
SMILESCCSc1ncc(-c2ccncc2)[nH]1
InChIInChI=1S/C10H11N3S/c1-2-14-10-12-7-9(13-10)8-3-5-11-6-4-8/h3-7H,2H2,1H3,(H,12,13)
InChIKeyHJNWBHLGVFSMIJ-UHFFFAOYSA-N
XLogP2.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-(5-pyridin-4-yl-1H-imidazol-2-yl)propan-1-amine
CID 116877077
3-(5-pyridin-4-yl-1H-imidazol-2-yl)butanoic acid
CID 116878821
2-[5-(4-ethylsulfanylphenyl)-1H-imidazol-2-yl]ethanethiol
CID 116879336
2-[(5-pyridin-4-yl-1H-imidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 10384977
5-(4-ethylsulfanylphenyl)-2-methoxy-1H-imidazole
CID 116883734
2-methylsulfanyl-5-phenyl-1H-imidazole
CID 3904984
ethyl 2-[[5-(4-chlorophenyl)-1H-imidazol-2-yl]sulfanyl]acetate
CID 1080939
[5-(4-ethylsulfanylphenyl)-1H-imidazol-2-yl]hydrazine
CID 116884155
4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]butan-1-ol
CID 166188173
4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanylmethyl]-2-propyl-1,3-thiazole
CID 46573002
5-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]pentan-2-one
CID 47163722
3-ethylsulfanyl-6-pyridin-4-ylpyridazine
CID 7207301

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine?
The IUPAC name of 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine (CID 141114690) is 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine.
What is the SMILES notation for 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine?
The canonical SMILES for 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine is CCSc1ncc(-c2ccncc2)[nH]1.
What is the InChIKey of 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine?
The InChIKey is HJNWBHLGVFSMIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c1-2-14-10-12-7-9(13-10)8-3-5-11-6-4-8/h3-7H,2H2,1H3,(H,12,13).
What are the key properties of 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine?
4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine has a molecular weight of 205.29 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylsulfanyl-1H-imidazol-5-yl)pyridine is sourced from PubChem (CID 141114690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).