4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine

C12H11N3O4 — CID 102703861

IUPAC4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine
SMILESCOc1ccc([N+](=O)[O-])c(Oc2ccnc(N)c2)c1
InChIInChI=1S/C12H11N3O4/c1-18-8-2-3-10(15(16)17)11(6-8)19-9-4-5-14-12(13)7-9/h2-7H,1H3,(H2,13,14)
InChIKeyBQCZJJNIPWJCFF-UHFFFAOYSA-N
MW261.24 g/mol
LogP2.37
Rot. Bonds4

About 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine

4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine (PubChem CID 102703861) has the molecular formula C12H11N3O4 and a molecular weight of 261.24 g/mol. Its IUPAC name is 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine.

Molecular Properties

Compound Name4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine
PubChem CID102703861
Molecular FormulaC12H11N3O4
Molecular Weight261.24 g/mol
Exact Mass261.07
IUPAC Name4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine
SMILESCOc1ccc([N+](=O)[O-])c(Oc2ccnc(N)c2)c1
InChIInChI=1S/C12H11N3O4/c1-18-8-2-3-10(15(16)17)11(6-8)19-9-4-5-14-12(13)7-9/h2-7H,1H3,(H2,13,14)
InChIKeyBQCZJJNIPWJCFF-UHFFFAOYSA-N
XLogP2.37
TPSA100.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.24
LogP ≤ 52.37
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

[4-(5-methoxy-2-nitrophenoxy)-2-pyridinyl]hydrazine
CID 102703909
4-(3-methyl-4-nitrophenoxy)pyridin-2-amine
CID 23153294
4-(4-nitronaphthalen-1-yl)oxypyridin-2-amine
CID 58532562
6-(5-methoxy-2-nitrophenoxy)-2-methylpyrimidin-4-amine
CID 102703887
hydron;4-methoxypyridin-2-amine
CID 131852579
1-[3-(5-methoxy-2-nitrophenoxy)phenyl]ethanamine
CID 102702770
4-[(7-nitro-1H-indazol-4-yl)oxy]pyridin-2-amine
CID 67450786
4-chloro-6-(5-methoxy-2-nitrophenoxy)-1,3,5-triazin-2-amine
CID 102703874
1-[5-(5-methoxy-2-nitrophenoxy)-2-pyridinyl]ethanol
CID 102702826
5-(5-methoxy-2-nitrophenoxy)pyridine-2-carboximidamide
CID 102702745
3-methoxy-4-(5-methoxy-2-nitrophenoxy)phenol
CID 163522418
3-(5-methoxy-2-nitrophenoxy)pyridine-2-carbonitrile
CID 102702690

Frequently Asked Questions

What is the IUPAC name of 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine?
The IUPAC name of 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine (CID 102703861) is 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine.
What is the SMILES notation for 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine?
The canonical SMILES for 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine is COc1ccc([N+](=O)[O-])c(Oc2ccnc(N)c2)c1.
What is the InChIKey of 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine?
The InChIKey is BQCZJJNIPWJCFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O4/c1-18-8-2-3-10(15(16)17)11(6-8)19-9-4-5-14-12(13)7-9/h2-7H,1H3,(H2,13,14).
What are the key properties of 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine?
4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine has a molecular weight of 261.24 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methoxy-2-nitrophenoxy)pyridin-2-amine is sourced from PubChem (CID 102703861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).