2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide

C12H10FN3O — CID 79522129

IUPAC2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide
SMILES[H]/N=C(\N)c1c(F)cccc1Oc1cccnc1
InChIInChI=1S/C12H10FN3O/c13-9-4-1-5-10(11(9)12(14)15)17-8-3-2-6-16-7-8/h1-7H,(H3,14,15)
InChIKeyLJPMMNGDRXAHTM-UHFFFAOYSA-N
MW231.23 g/mol
LogP2.30
Rot. Bonds3

About 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide

2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide (PubChem CID 79522129) has the molecular formula C12H10FN3O and a molecular weight of 231.23 g/mol. Its IUPAC name is 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide.

Molecular Properties

Compound Name2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide
PubChem CID79522129
Molecular FormulaC12H10FN3O
Molecular Weight231.23 g/mol
Exact Mass231.08
IUPAC Name2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide
SMILES[H]/N=C(\N)c1c(F)cccc1Oc1cccnc1
InChIInChI=1S/C12H10FN3O/c13-9-4-1-5-10(11(9)12(14)15)17-8-3-2-6-16-7-8/h1-7H,(H3,14,15)
InChIKeyLJPMMNGDRXAHTM-UHFFFAOYSA-N
XLogP2.30
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.23
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-(4-ethylphenoxy)-6-fluorobenzenecarboximidamide
CID 79520315
3,5-difluoro-4-pyridin-3-yloxybenzenecarboximidamide
CID 81293654
2-fluoro-6-[3-(methoxymethyl)phenoxy]benzenecarboximidamide
CID 79523185
2-fluoro-6-(2-methylphenoxy)benzenecarboximidamide
CID 79520393
2-fluoro-6-(4-nitrophenoxy)benzenecarboximidamide
CID 79017446
2-(2-chlorophenoxy)-6-fluorobenzenecarboximidamide;hydrochloride
CID 82240764
2-fluoro-6-[2-(2-hydroxyethyl)phenoxy]benzenecarboximidamide
CID 107712612
2,6-dipyridin-3-yloxyphenol
CID 139940524
2-chloro-6-phenoxybenzenecarboximidamide
CID 53416807
2-bromo-6-[(5-chloro-3-pyridinyl)oxy]benzenecarboximidamide
CID 114884097
2-[(5-chloro-3-pyridinyl)oxy]-6-fluorobenzenecarbothioamide
CID 79520433
2-fluoro-6-(2-methyl-5-propan-2-ylphenoxy)benzenecarboximidamide
CID 79517566

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide?
The IUPAC name of 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide (CID 79522129) is 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide.
What is the SMILES notation for 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide?
The canonical SMILES for 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide is [H]/N=C(\N)c1c(F)cccc1Oc1cccnc1.
What is the InChIKey of 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide?
The InChIKey is LJPMMNGDRXAHTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN3O/c13-9-4-1-5-10(11(9)12(14)15)17-8-3-2-6-16-7-8/h1-7H,(H3,14,15).
What are the key properties of 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide?
2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide has a molecular weight of 231.23 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-pyridin-3-yloxybenzenecarboximidamide is sourced from PubChem (CID 79522129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).