2-(3-chlorophenoxy)pyridine-3-carboxamide

C12H9ClN2O2 — CID 1211466

IUPAC2-(3-chlorophenoxy)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Oc1cccc(Cl)c1
InChIInChI=1S/C12H9ClN2O2/c13-8-3-1-4-9(7-8)17-12-10(11(14)16)5-2-6-15-12/h1-7H,(H2,14,16)
InChIKeyCZSWNYIDVFMMTR-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.63
Rot. Bonds3

About 2-(3-chlorophenoxy)pyridine-3-carboxamide

2-(3-chlorophenoxy)pyridine-3-carboxamide (PubChem CID 1211466) has the molecular formula C12H9ClN2O2 and a molecular weight of 248.67 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)pyridine-3-carboxamide
PubChem CID1211466
Molecular FormulaC12H9ClN2O2
Molecular Weight248.67 g/mol
Exact Mass248.04
IUPAC Name2-(3-chlorophenoxy)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1Oc1cccc(Cl)c1
InChIInChI=1S/C12H9ClN2O2/c13-8-3-1-4-9(7-8)17-12-10(11(14)16)5-2-6-15-12/h1-7H,(H2,14,16)
InChIKeyCZSWNYIDVFMMTR-UHFFFAOYSA-N
XLogP2.63
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.67
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)pyridine-3-carboxamide?
The IUPAC name of 2-(3-chlorophenoxy)pyridine-3-carboxamide (CID 1211466) is 2-(3-chlorophenoxy)pyridine-3-carboxamide.
What is the SMILES notation for 2-(3-chlorophenoxy)pyridine-3-carboxamide?
The canonical SMILES for 2-(3-chlorophenoxy)pyridine-3-carboxamide is NC(=O)c1cccnc1Oc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenoxy)pyridine-3-carboxamide?
The InChIKey is CZSWNYIDVFMMTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O2/c13-8-3-1-4-9(7-8)17-12-10(11(14)16)5-2-6-15-12/h1-7H,(H2,14,16).
What are the key properties of 2-(3-chlorophenoxy)pyridine-3-carboxamide?
2-(3-chlorophenoxy)pyridine-3-carboxamide has a molecular weight of 248.67 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)pyridine-3-carboxamide is sourced from PubChem (CID 1211466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).