2-cyclopentyl-5-nitropyridine

C10H12N2O2 — CID 58049556

IUPAC2-cyclopentyl-5-nitropyridine
SMILESO=[N+]([O-])c1ccc(C2CCCC2)nc1
InChIInChI=1S/C10H12N2O2/c13-12(14)9-5-6-10(11-7-9)8-3-1-2-4-8/h5-8H,1-4H2
InChIKeyODRADRAZJFWQPY-UHFFFAOYSA-N
MW192.22 g/mol
LogP2.65
Rot. Bonds2

About 2-cyclopentyl-5-nitropyridine

2-cyclopentyl-5-nitropyridine (PubChem CID 58049556) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 2-cyclopentyl-5-nitropyridine.

Molecular Properties

Compound Name2-cyclopentyl-5-nitropyridine
PubChem CID58049556
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name2-cyclopentyl-5-nitropyridine
SMILESO=[N+]([O-])c1ccc(C2CCCC2)nc1
InChIInChI=1S/C10H12N2O2/c13-12(14)9-5-6-10(11-7-9)8-3-1-2-4-8/h5-8H,1-4H2
InChIKeyODRADRAZJFWQPY-UHFFFAOYSA-N
XLogP2.65
TPSA56.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

4-(4-Nitrobenzyl)pyridine
CID 14129
2,3-Dimethyl-4-nitropyridine-N-oxide
CID 148223
3-Nitroquinoline
CID 25551
4-[2-(3-Nitrophenyl)ethenyl]pyridine
CID 788684
Pyridine, 2-((4-nitrophenyl)methyl)-
CID 69292
4-(4-Nitrophenyl)pyridine
CID 259219
2-Methyl-3-nitropyridine
CID 329360
2-(3-Nitrophenyl)pyridine
CID 459555
2-(4-Nitrophenyl)pyridine
CID 459556
2-[(E)-2-(4-nitrophenyl)vinyl]pyridine
CID 5376482
3-(4-Nitrophenyl)pyridine
CID 231504
4-[(E)-2-(4-nitrophenyl)vinyl]pyridine
CID 5373339

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-nitropyridine?
The IUPAC name of 2-cyclopentyl-5-nitropyridine (CID 58049556) is 2-cyclopentyl-5-nitropyridine.
What is the SMILES notation for 2-cyclopentyl-5-nitropyridine?
The canonical SMILES for 2-cyclopentyl-5-nitropyridine is O=[N+]([O-])c1ccc(C2CCCC2)nc1.
What is the InChIKey of 2-cyclopentyl-5-nitropyridine?
The InChIKey is ODRADRAZJFWQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c13-12(14)9-5-6-10(11-7-9)8-3-1-2-4-8/h5-8H,1-4H2.
What are the key properties of 2-cyclopentyl-5-nitropyridine?
2-cyclopentyl-5-nitropyridine has a molecular weight of 192.22 g/mol, XLogP of 2.65, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-nitropyridine is sourced from PubChem (CID 58049556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).