5-amino-2-phenoxypyridine-3-carbonitrile

C12H9N3O — CID 60923162

IUPAC5-amino-2-phenoxypyridine-3-carbonitrile
SMILESN#Cc1cc(N)cnc1Oc1ccccc1
InChIInChI=1S/C12H9N3O/c13-7-9-6-10(14)8-15-12(9)16-11-4-2-1-3-5-11/h1-6,8H,14H2
InChIKeyVDBAFDNFOMENFP-UHFFFAOYSA-N
MW211.22 g/mol
LogP2.33
Rot. Bonds2

About 5-amino-2-phenoxypyridine-3-carbonitrile

5-amino-2-phenoxypyridine-3-carbonitrile (PubChem CID 60923162) has the molecular formula C12H9N3O and a molecular weight of 211.22 g/mol. Its IUPAC name is 5-amino-2-phenoxypyridine-3-carbonitrile.

Molecular Properties

Compound Name5-amino-2-phenoxypyridine-3-carbonitrile
PubChem CID60923162
Molecular FormulaC12H9N3O
Molecular Weight211.22 g/mol
Exact Mass211.07
IUPAC Name5-amino-2-phenoxypyridine-3-carbonitrile
SMILESN#Cc1cc(N)cnc1Oc1ccccc1
InChIInChI=1S/C12H9N3O/c13-7-9-6-10(14)8-15-12(9)16-11-4-2-1-3-5-11/h1-6,8H,14H2
InChIKeyVDBAFDNFOMENFP-UHFFFAOYSA-N
XLogP2.33
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-2-(3-fluorophenoxy)pyridine-3-carbonitrile
CID 54861089
5-amino-2-(3-ethoxyphenoxy)pyridine-3-carbonitrile
CID 62338626
5-amino-2-(3,5-dichlorophenoxy)pyridine-3-carbonitrile
CID 54861104
5-amino-2-(3,5-dimethoxyphenoxy)pyridine-3-carbonitrile
CID 60923806
5-amino-2-(3-methylsulfonylphenoxy)pyridine-3-carbonitrile
CID 60924024
5-amino-2-(3-chloro-4-fluorophenoxy)pyridine-3-carbonitrile
CID 63878450
5-amino-2-(2,3-dichlorophenoxy)pyridine-3-carbonitrile
CID 54860994
5-amino-2-(5-fluoro-2-methylphenoxy)pyridine-3-carbonitrile
CID 102980272
5-amino-2-(2-fluoro-5-methylphenoxy)pyridine-3-carbonitrile
CID 64854984
5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile
CID 60923164
4,5-diphenoxybenzene-1,2-dicarbonitrile
CID 680327
5-amino-2-(1,1,1-trifluoropropan-2-yloxy)pyridine-3-carbonitrile
CID 66276281

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-phenoxypyridine-3-carbonitrile?
The IUPAC name of 5-amino-2-phenoxypyridine-3-carbonitrile (CID 60923162) is 5-amino-2-phenoxypyridine-3-carbonitrile.
What is the SMILES notation for 5-amino-2-phenoxypyridine-3-carbonitrile?
The canonical SMILES for 5-amino-2-phenoxypyridine-3-carbonitrile is N#Cc1cc(N)cnc1Oc1ccccc1.
What is the InChIKey of 5-amino-2-phenoxypyridine-3-carbonitrile?
The InChIKey is VDBAFDNFOMENFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O/c13-7-9-6-10(14)8-15-12(9)16-11-4-2-1-3-5-11/h1-6,8H,14H2.
What are the key properties of 5-amino-2-phenoxypyridine-3-carbonitrile?
5-amino-2-phenoxypyridine-3-carbonitrile has a molecular weight of 211.22 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-phenoxypyridine-3-carbonitrile is sourced from PubChem (CID 60923162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).