2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide

C20H16Cl2N2O2 — CID 46194702

IUPAC2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cccnc1Oc1cc(Cl)ccc1Cl)c1ccccc1
InChIInChI=1S/C20H16Cl2N2O2/c1-2-24(15-7-4-3-5-8-15)20(25)16-9-6-12-23-19(16)26-18-13-14(21)10-11-17(18)22/h3-13H,2H2,1H3
InChIKeyMOGGFCNVSDQDAC-UHFFFAOYSA-N
MW387.27 g/mol
LogP5.85
Rot. Bonds5

About 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide

2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide (PubChem CID 46194702) has the molecular formula C20H16Cl2N2O2 and a molecular weight of 387.27 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide
PubChem CID46194702
Molecular FormulaC20H16Cl2N2O2
Molecular Weight387.27 g/mol
Exact Mass386.06
IUPAC Name2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cccnc1Oc1cc(Cl)ccc1Cl)c1ccccc1
InChIInChI=1S/C20H16Cl2N2O2/c1-2-24(15-7-4-3-5-8-15)20(25)16-9-6-12-23-19(16)26-18-13-14(21)10-11-17(18)22/h3-13H,2H2,1H3
InChIKeyMOGGFCNVSDQDAC-UHFFFAOYSA-N
XLogP5.85
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.27
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide (CID 46194702) is 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide is CCN(C(=O)c1cccnc1Oc1cc(Cl)ccc1Cl)c1ccccc1.
What is the InChIKey of 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide?
The InChIKey is MOGGFCNVSDQDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16Cl2N2O2/c1-2-24(15-7-4-3-5-8-15)20(25)16-9-6-12-23-19(16)26-18-13-14(21)10-11-17(18)22/h3-13H,2H2,1H3.
What are the key properties of 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide?
2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide has a molecular weight of 387.27 g/mol, XLogP of 5.85, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 46194702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).