5-nitro-2-pyrazolidin-1-ylpyridine

C8H10N4O2 — CID 130927658

IUPAC5-nitro-2-pyrazolidin-1-ylpyridine
SMILESO=[N+]([O-])c1ccc(N2CCCN2)nc1
InChIInChI=1S/C8H10N4O2/c13-12(14)7-2-3-8(9-6-7)11-5-1-4-10-11/h2-3,6,10H,1,4-5H2
InChIKeyMXXHPRVSYJXKCP-UHFFFAOYSA-N
MW194.19 g/mol
LogP0.70
Rot. Bonds2

About 5-nitro-2-pyrazolidin-1-ylpyridine

5-nitro-2-pyrazolidin-1-ylpyridine (PubChem CID 130927658) has the molecular formula C8H10N4O2 and a molecular weight of 194.19 g/mol. Its IUPAC name is 5-nitro-2-pyrazolidin-1-ylpyridine.

Molecular Properties

Compound Name5-nitro-2-pyrazolidin-1-ylpyridine
PubChem CID130927658
Molecular FormulaC8H10N4O2
Molecular Weight194.19 g/mol
Exact Mass194.08
IUPAC Name5-nitro-2-pyrazolidin-1-ylpyridine
SMILESO=[N+]([O-])c1ccc(N2CCCN2)nc1
InChIInChI=1S/C8H10N4O2/c13-12(14)7-2-3-8(9-6-7)11-5-1-4-10-11/h2-3,6,10H,1,4-5H2
InChIKeyMXXHPRVSYJXKCP-UHFFFAOYSA-N
XLogP0.70
TPSA71.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.70
H-Bond Donors ≤ 51
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-(5-nitro-2-pyridinyl)-3,9-diazaspiro[5.5]undecane
CID 71302762
4,4-dimethyl-1-(5-nitro-2-pyridinyl)azepane
CID 133323311
6-[4-(5-nitro-2-pyridinyl)piperazin-1-yl]pyridine-3-carbonitrile
CID 133271157
1-(5-nitro-2-pyridinyl)-1,3-diazinane-2,4-dione
CID 166553476
2,2-difluoro-7-(5-nitro-2-pyridinyl)-7-azaspiro[3.5]nonane
CID 118275346
3-(5-nitro-2-pyridinyl)-3-azabicyclo[3.2.0]heptane
CID 66907896
1-ethyl-4-(5-nitro-2-pyridinyl)piperazine
CID 2848980
3-(5-nitro-2-pyridinyl)-1,3-thiazolidin-2-one
CID 53396679
4-(5-nitro-2-pyridinyl)-1,4-diazepane-1-carboxylic acid
CID 68559517
5-nitro-2-(4-nitropyrazol-1-yl)pyridine
CID 12602756
1-(5-nitro-2-pyridinyl)piperidine-4-carbaldehyde
CID 62663272
1-(5-nitro-2-pyridinyl)-4-piperidin-1-ylpiperidine-4-carboxamide
CID 3165093

Frequently Asked Questions

What is the IUPAC name of 5-nitro-2-pyrazolidin-1-ylpyridine?
The IUPAC name of 5-nitro-2-pyrazolidin-1-ylpyridine (CID 130927658) is 5-nitro-2-pyrazolidin-1-ylpyridine.
What is the SMILES notation for 5-nitro-2-pyrazolidin-1-ylpyridine?
The canonical SMILES for 5-nitro-2-pyrazolidin-1-ylpyridine is O=[N+]([O-])c1ccc(N2CCCN2)nc1.
What is the InChIKey of 5-nitro-2-pyrazolidin-1-ylpyridine?
The InChIKey is MXXHPRVSYJXKCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O2/c13-12(14)7-2-3-8(9-6-7)11-5-1-4-10-11/h2-3,6,10H,1,4-5H2.
What are the key properties of 5-nitro-2-pyrazolidin-1-ylpyridine?
5-nitro-2-pyrazolidin-1-ylpyridine has a molecular weight of 194.19 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-nitro-2-pyrazolidin-1-ylpyridine is sourced from PubChem (CID 130927658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).