methane;5-nitropyridin-2-amine

C6H9N3O2 — CID 174857781

IUPACmethane;5-nitropyridin-2-amine
SMILESC.Nc1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C5H5N3O2.CH4/c6-5-2-1-4(3-7-5)8(9)10;/h1-3H,(H2,6,7);1H4
InChIKeyNOROAJXGNNSZMJ-UHFFFAOYSA-N
MW155.16 g/mol
LogP1.21
Rot. Bonds1

About methane;5-nitropyridin-2-amine

methane;5-nitropyridin-2-amine (PubChem CID 174857781) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is methane;5-nitropyridin-2-amine.

Molecular Properties

Compound Namemethane;5-nitropyridin-2-amine
PubChem CID174857781
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Namemethane;5-nitropyridin-2-amine
SMILESC.Nc1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C5H5N3O2.CH4/c6-5-2-1-4(3-7-5)8(9)10;/h1-3H,(H2,6,7);1H4
InChIKeyNOROAJXGNNSZMJ-UHFFFAOYSA-N
XLogP1.21
TPSA82.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

2-chloro-5-nitropyridine;6-chloropyridin-3-amine
CID 87669080
ethane;2-methyl-5-nitropyridine
CID 123657002
(2R)-1-(5-nitro-2-pyridinyl)propan-2-amine
CID 95028659
5-nitropyridine-2-carbothioamide
CID 82668935
N-methyl-1-(5-nitro-2-pyridinyl)methanamine
CID 144940815
3-(5-nitro-2-pyridinyl)butan-2-amine
CID 63198306
ethane;2-methylsulfanyl-5-nitropyridine
CID 142860412
3,3-dimethyl-1-(5-nitro-2-pyridinyl)butan-2-amine
CID 63196346
2-(5-nitro-2-pyridinyl)-1-phenylethanamine
CID 55162185
N-(6-amino-3-pyridinyl)-2-fluoro-5-nitrobenzamide
CID 62901689
N-(6-amino-3-pyridinyl)-2-methyl-5-nitrobenzenesulfonamide
CID 60792562
6-amino-N-(2-fluoro-5-nitrophenyl)pyridine-3-carboxamide
CID 62155644

Frequently Asked Questions

What is the IUPAC name of methane;5-nitropyridin-2-amine?
The IUPAC name of methane;5-nitropyridin-2-amine (CID 174857781) is methane;5-nitropyridin-2-amine.
What is the SMILES notation for methane;5-nitropyridin-2-amine?
The canonical SMILES for methane;5-nitropyridin-2-amine is C.Nc1ccc([N+](=O)[O-])cn1.
What is the InChIKey of methane;5-nitropyridin-2-amine?
The InChIKey is NOROAJXGNNSZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N3O2.CH4/c6-5-2-1-4(3-7-5)8(9)10;/h1-3H,(H2,6,7);1H4.
What are the key properties of methane;5-nitropyridin-2-amine?
methane;5-nitropyridin-2-amine has a molecular weight of 155.16 g/mol, XLogP of 1.21, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methane;5-nitropyridin-2-amine is sourced from PubChem (CID 174857781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).