6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine

C11H8N6O2 — CID 102627390

IUPAC6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine
SMILESNc1ncnc(-c2cccc3nccn23)c1[N+](=O)[O-]
InChIInChI=1S/C11H8N6O2/c12-11-10(17(18)19)9(14-6-15-11)7-2-1-3-8-13-4-5-16(7)8/h1-6H,(H2,12,14,15)
InChIKeyWXTGULVNRVQYHY-UHFFFAOYSA-N
MW256.23 g/mol
LogP1.28
Rot. Bonds2

About 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine

6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine (PubChem CID 102627390) has the molecular formula C11H8N6O2 and a molecular weight of 256.23 g/mol. Its IUPAC name is 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine.

Molecular Properties

Compound Name6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine
PubChem CID102627390
Molecular FormulaC11H8N6O2
Molecular Weight256.23 g/mol
Exact Mass256.07
IUPAC Name6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine
SMILESNc1ncnc(-c2cccc3nccn23)c1[N+](=O)[O-]
InChIInChI=1S/C11H8N6O2/c12-11-10(17(18)19)9(14-6-15-11)7-2-1-3-8-13-4-5-16(7)8/h1-6H,(H2,12,14,15)
InChIKeyWXTGULVNRVQYHY-UHFFFAOYSA-N
XLogP1.28
TPSA112.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.23
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-(5-chloropyrimidin-4-yl)imidazo[1,2-a]pyridine
CID 102627237
5-imidazo[1,2-a]pyridin-5-ylpyrimidin-2-amine
CID 102626318
2-imidazo[1,2-a]pyridin-5-ylaniline
CID 102626302
5-nitro-6-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)pyrimidin-4-amine
CID 112724176
6-(2,3-dihydro-1-benzofuran-7-yl)-5-nitropyrimidin-4-amine
CID 114747242
3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole
CID 102627264
N-ethyl-6-imidazo[1,2-a]pyridin-5-yl-5-propan-2-ylpyrimidin-4-amine
CID 102627295
ethane;5-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 142047032
4-N-(2,6-difluorophenyl)-5-nitropyrimidine-4,6-diamine
CID 2959694
4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde
CID 171095802
5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-amine
CID 23489047
5-nitro-4-N-(3-nitrophenyl)pyrimidine-4,6-diamine
CID 4140408

Frequently Asked Questions

What is the IUPAC name of 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine?
The IUPAC name of 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine (CID 102627390) is 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine.
What is the SMILES notation for 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine?
The canonical SMILES for 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine is Nc1ncnc(-c2cccc3nccn23)c1[N+](=O)[O-].
What is the InChIKey of 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine?
The InChIKey is WXTGULVNRVQYHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N6O2/c12-11-10(17(18)19)9(14-6-15-11)7-2-1-3-8-13-4-5-16(7)8/h1-6H,(H2,12,14,15).
What are the key properties of 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine?
6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine has a molecular weight of 256.23 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine is sourced from PubChem (CID 102627390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).