2-(1H-imidazol-5-yl)-4-nitrosopyridine

C8H6N4O — CID 166968725

IUPAC2-(1H-imidazol-5-yl)-4-nitrosopyridine
SMILESO=Nc1ccnc(-c2cnc[nH]2)c1
InChIInChI=1S/C8H6N4O/c13-12-6-1-2-10-7(3-6)8-4-9-5-11-8/h1-5H,(H,9,11)
InChIKeyCKJDCWUPRBCUDP-UHFFFAOYSA-N
MW174.16 g/mol
LogP1.87
Rot. Bonds2

About 2-(1H-imidazol-5-yl)-4-nitrosopyridine

2-(1H-imidazol-5-yl)-4-nitrosopyridine (PubChem CID 166968725) has the molecular formula C8H6N4O and a molecular weight of 174.16 g/mol. Its IUPAC name is 2-(1H-imidazol-5-yl)-4-nitrosopyridine.

Molecular Properties

Compound Name2-(1H-imidazol-5-yl)-4-nitrosopyridine
PubChem CID166968725
Molecular FormulaC8H6N4O
Molecular Weight174.16 g/mol
Exact Mass174.05
IUPAC Name2-(1H-imidazol-5-yl)-4-nitrosopyridine
SMILESO=Nc1ccnc(-c2cnc[nH]2)c1
InChIInChI=1S/C8H6N4O/c13-12-6-1-2-10-7(3-6)8-4-9-5-11-8/h1-5H,(H,9,11)
InChIKeyCKJDCWUPRBCUDP-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

2-(1H-imidazol-5-yl)-4-(2H-triazol-4-yl)pyridine
CID 130431425
2-(1H-imidazol-5-yl)pyrazine;dihydrochloride
CID 91798971
ethane;2-(1H-imidazol-5-yl)pyridine
CID 144804371
2-(1H-imidazol-5-yl)-6-nitrosopyridine
CID 122592443
4-(1H-imidazol-5-yl)-2-phenylpyrimidine
CID 90707377
2-(1H-imidazol-5-yl)-3-nitroso-1H-indole
CID 122592451
3-(1H-imidazol-5-yl)-1,2-oxazole-5-carboxylic acid
CID 137212082
4-(1H-imidazol-5-yl)quinoline
CID 11063321
N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine
CID 20561064
6-(1H-imidazol-5-yl)pyridine-2-carboxylic acid
CID 82404817
2-[3-(1H-imidazol-5-yl)phenoxy]acetic acid
CID 69090482
3-(1H-imidazol-5-yl)pyridine;hydrochloride
CID 67500499

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-5-yl)-4-nitrosopyridine?
The IUPAC name of 2-(1H-imidazol-5-yl)-4-nitrosopyridine (CID 166968725) is 2-(1H-imidazol-5-yl)-4-nitrosopyridine.
What is the SMILES notation for 2-(1H-imidazol-5-yl)-4-nitrosopyridine?
The canonical SMILES for 2-(1H-imidazol-5-yl)-4-nitrosopyridine is O=Nc1ccnc(-c2cnc[nH]2)c1.
What is the InChIKey of 2-(1H-imidazol-5-yl)-4-nitrosopyridine?
The InChIKey is CKJDCWUPRBCUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4O/c13-12-6-1-2-10-7(3-6)8-4-9-5-11-8/h1-5H,(H,9,11).
What are the key properties of 2-(1H-imidazol-5-yl)-4-nitrosopyridine?
2-(1H-imidazol-5-yl)-4-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)-4-nitrosopyridine is sourced from PubChem (CID 166968725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).