3-methoxy-N-methyl-5-nitropyridin-2-amine

C7H9N3O3 — CID 90022055

IUPAC3-methoxy-N-methyl-5-nitropyridin-2-amine
SMILESCNc1ncc([N+](=O)[O-])cc1OC
InChIInChI=1S/C7H9N3O3/c1-8-7-6(13-2)3-5(4-9-7)10(11)12/h3-4H,1-2H3,(H,8,9)
InChIKeyUZQYWWLZFSDHMD-UHFFFAOYSA-N
MW183.17 g/mol
LogP1.04
Rot. Bonds3

About 3-methoxy-N-methyl-5-nitropyridin-2-amine

3-methoxy-N-methyl-5-nitropyridin-2-amine (PubChem CID 90022055) has the molecular formula C7H9N3O3 and a molecular weight of 183.17 g/mol. Its IUPAC name is 3-methoxy-N-methyl-5-nitropyridin-2-amine.

Molecular Properties

Compound Name3-methoxy-N-methyl-5-nitropyridin-2-amine
PubChem CID90022055
Molecular FormulaC7H9N3O3
Molecular Weight183.17 g/mol
Exact Mass183.06
IUPAC Name3-methoxy-N-methyl-5-nitropyridin-2-amine
SMILESCNc1ncc([N+](=O)[O-])cc1OC
InChIInChI=1S/C7H9N3O3/c1-8-7-6(13-2)3-5(4-9-7)10(11)12/h3-4H,1-2H3,(H,8,9)
InChIKeyUZQYWWLZFSDHMD-UHFFFAOYSA-N
XLogP1.04
TPSA77.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 51.04
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-methoxy-2-(4-methylpentoxy)-5-nitropyridine
CID 58153349
N-(4-bromo-3-methoxyphenyl)-3-methyl-5-nitropyridin-2-amine
CID 133428545
N-tert-butyl-2-(methylamino)-5-nitropyridine-3-carboxamide
CID 114047907
N-(3-hydroxy-5-nitro-2-pyridinyl)-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 110504719
N-(2,5-dimethoxyphenyl)-5-nitropyridin-2-amine
CID 3750418
6-(2-bromo-5-nitrophenoxy)-5-methoxy-N-methylpyrimidin-4-amine
CID 103013779
2-N,4-N-dimethyl-3,6-dinitro-1,8-naphthyridine-2,4-diamine
CID 15448616
3-bromo-N-tert-butyl-5-nitropyridin-2-amine
CID 82488870
2-methoxy-5-nitro-3-propan-2-ylpyridine
CID 175836556
2-bromo-3-ethoxy-5-nitropyridine
CID 119000292
3,5-dinitro-N-propan-2-ylpyridin-2-amine
CID 162519856
N-(3-methoxypropyl)-3-methyl-5-nitropyridin-2-amine
CID 62477722

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-methyl-5-nitropyridin-2-amine?
The IUPAC name of 3-methoxy-N-methyl-5-nitropyridin-2-amine (CID 90022055) is 3-methoxy-N-methyl-5-nitropyridin-2-amine.
What is the SMILES notation for 3-methoxy-N-methyl-5-nitropyridin-2-amine?
The canonical SMILES for 3-methoxy-N-methyl-5-nitropyridin-2-amine is CNc1ncc([N+](=O)[O-])cc1OC.
What is the InChIKey of 3-methoxy-N-methyl-5-nitropyridin-2-amine?
The InChIKey is UZQYWWLZFSDHMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3/c1-8-7-6(13-2)3-5(4-9-7)10(11)12/h3-4H,1-2H3,(H,8,9).
What are the key properties of 3-methoxy-N-methyl-5-nitropyridin-2-amine?
3-methoxy-N-methyl-5-nitropyridin-2-amine has a molecular weight of 183.17 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-methyl-5-nitropyridin-2-amine is sourced from PubChem (CID 90022055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).