N-(2-nitrophenyl)pyridin-4-amine

C11H9N3O2 — CID 2784609

IUPACN-(2-nitrophenyl)pyridin-4-amine
SMILESO=[N+]([O-])c1ccccc1Nc1ccncc1
InChIInChI=1S/C11H9N3O2/c15-14(16)11-4-2-1-3-10(11)13-9-5-7-12-8-6-9/h1-8H,(H,12,13)
InChIKeyVHQUELUASRQSPI-UHFFFAOYSA-N
MW215.21 g/mol
LogP2.73
Rot. Bonds3

About N-(2-nitrophenyl)pyridin-4-amine

N-(2-nitrophenyl)pyridin-4-amine (PubChem CID 2784609) has the molecular formula C11H9N3O2 and a molecular weight of 215.21 g/mol. Its IUPAC name is N-(2-nitrophenyl)pyridin-4-amine.

Molecular Properties

Compound NameN-(2-nitrophenyl)pyridin-4-amine
PubChem CID2784609
Molecular FormulaC11H9N3O2
Molecular Weight215.21 g/mol
Exact Mass215.07
IUPAC NameN-(2-nitrophenyl)pyridin-4-amine
SMILESO=[N+]([O-])c1ccccc1Nc1ccncc1
InChIInChI=1S/C11H9N3O2/c15-14(16)11-4-2-1-3-10(11)13-9-5-7-12-8-6-9/h1-8H,(H,12,13)
InChIKeyVHQUELUASRQSPI-UHFFFAOYSA-N
XLogP2.73
TPSA68.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 52.73
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-nitro-N-(4-pyridin-4-yloxyphenyl)aniline
CID 146172805
2-bromo-N-(2-nitrophenyl)pyridin-4-amine
CID 151479059
N-(4-methoxy-2-nitrophenyl)pyridin-4-amine
CID 121011704
methyl 3-(2-nitroanilino)pyridine-4-carboxylate
CID 170913350
3,4-difluoro-N-(2-nitrophenyl)aniline
CID 59560768
N-(4-methylsulfonylphenyl)-3-nitropyridin-4-amine
CID 118027362
2-nitro-N-pyridin-4-ylbenzamide
CID 766646
2-methyl-N-(2-nitrophenyl)pyrazol-3-amine
CID 142742599
2-[2-(2-nitroanilino)phenyl]acetic acid
CID 18546327
N-(2-nitrophenyl)thiohydroxylamine
CID 59024861
(2-chlorophenyl)-[4-(2-nitroanilino)phenyl]methanone
CID 18358103
N-cyclopropyl-4-(2-nitroanilino)benzenesulfonamide
CID 118007792

Frequently Asked Questions

What is the IUPAC name of N-(2-nitrophenyl)pyridin-4-amine?
The IUPAC name of N-(2-nitrophenyl)pyridin-4-amine (CID 2784609) is N-(2-nitrophenyl)pyridin-4-amine.
What is the SMILES notation for N-(2-nitrophenyl)pyridin-4-amine?
The canonical SMILES for N-(2-nitrophenyl)pyridin-4-amine is O=[N+]([O-])c1ccccc1Nc1ccncc1.
What is the InChIKey of N-(2-nitrophenyl)pyridin-4-amine?
The InChIKey is VHQUELUASRQSPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2/c15-14(16)11-4-2-1-3-10(11)13-9-5-7-12-8-6-9/h1-8H,(H,12,13).
What are the key properties of N-(2-nitrophenyl)pyridin-4-amine?
N-(2-nitrophenyl)pyridin-4-amine has a molecular weight of 215.21 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-nitrophenyl)pyridin-4-amine is sourced from PubChem (CID 2784609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).