2-(1H-imidazol-5-yl)-6-nitrosopyridine

C8H6N4O — CID 122592443

IUPAC2-(1H-imidazol-5-yl)-6-nitrosopyridine
SMILESO=Nc1cccc(-c2cnc[nH]2)n1
InChIInChI=1S/C8H6N4O/c13-12-8-3-1-2-6(11-8)7-4-9-5-10-7/h1-5H,(H,9,10)
InChIKeyZKCINPSPUFVNPV-UHFFFAOYSA-N
MW174.16 g/mol
LogP1.87
Rot. Bonds2

About 2-(1H-imidazol-5-yl)-6-nitrosopyridine

2-(1H-imidazol-5-yl)-6-nitrosopyridine (PubChem CID 122592443) has the molecular formula C8H6N4O and a molecular weight of 174.16 g/mol. Its IUPAC name is 2-(1H-imidazol-5-yl)-6-nitrosopyridine.

Molecular Properties

Compound Name2-(1H-imidazol-5-yl)-6-nitrosopyridine
PubChem CID122592443
Molecular FormulaC8H6N4O
Molecular Weight174.16 g/mol
Exact Mass174.05
IUPAC Name2-(1H-imidazol-5-yl)-6-nitrosopyridine
SMILESO=Nc1cccc(-c2cnc[nH]2)n1
InChIInChI=1S/C8H6N4O/c13-12-8-3-1-2-6(11-8)7-4-9-5-10-7/h1-5H,(H,9,10)
InChIKeyZKCINPSPUFVNPV-UHFFFAOYSA-N
XLogP1.87
TPSA71.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.16
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(1H-imidazol-5-yl)pyridine-2-carboxylic acid
CID 82404817
2-(1H-imidazol-5-yl)-4-nitrosopyridine
CID 166968725
ethane;2-(1H-imidazol-5-yl)pyridine
CID 144804371
4-(1H-imidazol-5-yl)-2-phenylpyrimidine
CID 90707377
2-(1H-imidazol-5-yl)-3-nitroso-1H-indole
CID 122592451
5-(1H-imidazol-5-yl)naphthalen-1-ol
CID 174313380
bis[2-(1H-imidazol-5-yl)phenyl]methanone
CID 118549351
2-(1H-imidazol-5-yl)pyrazine;dihydrochloride
CID 91798971
2-[3-(1H-imidazol-5-yl)phenoxy]acetic acid
CID 69090482
3-(1H-imidazol-5-yl)pyridine;hydrochloride
CID 67500499
2-(1H-imidazol-5-yl)aniline
CID 14698017
2-(1H-imidazol-5-yl)quinazoline
CID 91268038

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-5-yl)-6-nitrosopyridine?
The IUPAC name of 2-(1H-imidazol-5-yl)-6-nitrosopyridine (CID 122592443) is 2-(1H-imidazol-5-yl)-6-nitrosopyridine.
What is the SMILES notation for 2-(1H-imidazol-5-yl)-6-nitrosopyridine?
The canonical SMILES for 2-(1H-imidazol-5-yl)-6-nitrosopyridine is O=Nc1cccc(-c2cnc[nH]2)n1.
What is the InChIKey of 2-(1H-imidazol-5-yl)-6-nitrosopyridine?
The InChIKey is ZKCINPSPUFVNPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4O/c13-12-8-3-1-2-6(11-8)7-4-9-5-10-7/h1-5H,(H,9,10).
What are the key properties of 2-(1H-imidazol-5-yl)-6-nitrosopyridine?
2-(1H-imidazol-5-yl)-6-nitrosopyridine has a molecular weight of 174.16 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-5-yl)-6-nitrosopyridine is sourced from PubChem (CID 122592443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).