N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide

C11H9N3O5 — CID 51143054

IUPACN-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cn1
InChIInChI=1S/C11H9N3O5/c1-18-9-4-2-7(6-12-9)13-11(15)8-3-5-10(19-8)14(16)17/h2-6H,1H3,(H,13,15)
InChIKeyUOZDKKILASXKST-UHFFFAOYSA-N
MW263.21 g/mol
LogP1.84
Rot. Bonds4

About N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide

N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide (PubChem CID 51143054) has the molecular formula C11H9N3O5 and a molecular weight of 263.21 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide
PubChem CID51143054
Molecular FormulaC11H9N3O5
Molecular Weight263.21 g/mol
Exact Mass263.05
IUPAC NameN-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cn1
InChIInChI=1S/C11H9N3O5/c1-18-9-4-2-7(6-12-9)13-11(15)8-3-5-10(19-8)14(16)17/h2-6H,1H3,(H,13,15)
InChIKeyUOZDKKILASXKST-UHFFFAOYSA-N
XLogP1.84
TPSA107.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.21
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

N-(3,5-dimethylphenyl)-5-nitrofuran-2-carboxamide
CID 757048
2-hydroxy-N-(6-methoxy-3-pyridinyl)-3-nitrobenzamide
CID 103746259
N-(4-methyl-3-nitrophenyl)-5-nitrofuran-2-carboxamide
CID 17146040
3-chloro-N-(6-methoxy-3-pyridinyl)-4-nitrobenzamide
CID 82776170
2-chloro-N-(6-methoxy-3-pyridinyl)-4-nitrobenzamide
CID 26515816
5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide
CID 47051131
6-methoxy-N-[(4-nitrophenyl)methyl]pyridin-3-amine
CID 19874084
N-(3,4-difluorophenyl)-5-nitrofuran-2-carboxamide
CID 5153997
N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-5-nitrofuran-2-carboxamide
CID 24692016
N-[3-(methoxymethyl)phenyl]-5-nitrofuran-2-carboxamide
CID 33098918
N-[4-[2-(dimethylamino)propanoylamino]phenyl]-5-nitrofuran-2-carboxamide
CID 155681473
N-(2-ethyl-1,3-benzoxazol-5-yl)-5-nitrofuran-2-carboxamide
CID 60556890

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide (CID 51143054) is N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide is COc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide?
The InChIKey is UOZDKKILASXKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O5/c1-18-9-4-2-7(6-12-9)13-11(15)8-3-5-10(19-8)14(16)17/h2-6H,1H3,(H,13,15).
What are the key properties of N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide?
N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide has a molecular weight of 263.21 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide is sourced from PubChem (CID 51143054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).