2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine

C11H7N3O2S — CID 102365056

IUPAC2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine
SMILESO=[N+]([O-])c1nc2ccccn2c1-c1cccs1
InChIInChI=1S/C11H7N3O2S/c15-14(16)11-10(8-4-3-7-17-8)13-6-2-1-5-9(13)12-11/h1-7H
InChIKeyKMHCKLOGCZTSPQ-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.97
Rot. Bonds2

About 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine

2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine (PubChem CID 102365056) has the molecular formula C11H7N3O2S and a molecular weight of 245.26 g/mol. Its IUPAC name is 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine
PubChem CID102365056
Molecular FormulaC11H7N3O2S
Molecular Weight245.26 g/mol
Exact Mass245.03
IUPAC Name2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine
SMILESO=[N+]([O-])c1nc2ccccn2c1-c1cccs1
InChIInChI=1S/C11H7N3O2S/c15-14(16)11-10(8-4-3-7-17-8)13-6-2-1-5-9(13)12-11/h1-7H
InChIKeyKMHCKLOGCZTSPQ-UHFFFAOYSA-N
XLogP2.97
TPSA60.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

3-thiophen-2-ylimidazo[1,2-a]pyridine
CID 154553169
3-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridine
CID 56933914
3-nitro-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]thiophen-2-amine
CID 75398510
8-nitro-2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 82566551
4-chloro-N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 979718
2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 11830469
N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
CID 808655
2-(6-nitro-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 82055161
4-methyl-N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 751469
2-methyl-N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 5141011
3-thiophen-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 957617
2-(4-nitrophenyl)thiophene
CID 609512

Frequently Asked Questions

What is the IUPAC name of 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine?
The IUPAC name of 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine (CID 102365056) is 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine is O=[N+]([O-])c1nc2ccccn2c1-c1cccs1.
What is the InChIKey of 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine?
The InChIKey is KMHCKLOGCZTSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3O2S/c15-14(16)11-10(8-4-3-7-17-8)13-6-2-1-5-9(13)12-11/h1-7H.
What are the key properties of 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine?
2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine has a molecular weight of 245.26 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-nitro-3-thiophen-2-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 102365056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).