2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide

C16H16Cl2N2O4 — CID 86930838

IUPAC2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
SMILESCOCCOc1cc(NC(=O)c2cc(Cl)nc(Cl)c2)ccc1OC
InChIInChI=1S/C16H16Cl2N2O4/c1-22-5-6-24-13-9-11(3-4-12(13)23-2)19-16(21)10-7-14(17)20-15(18)8-10/h3-4,7-9H,5-6H2,1-2H3,(H,19,21)
InChIKeyLIZLQGUFZPVSGV-UHFFFAOYSA-N
MW371.22 g/mol
LogP3.67
Rot. Bonds7

About 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide

2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide (PubChem CID 86930838) has the molecular formula C16H16Cl2N2O4 and a molecular weight of 371.22 g/mol. Its IUPAC name is 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
PubChem CID86930838
Molecular FormulaC16H16Cl2N2O4
Molecular Weight371.22 g/mol
Exact Mass370.05
IUPAC Name2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
SMILESCOCCOc1cc(NC(=O)c2cc(Cl)nc(Cl)c2)ccc1OC
InChIInChI=1S/C16H16Cl2N2O4/c1-22-5-6-24-13-9-11(3-4-12(13)23-2)19-16(21)10-7-14(17)20-15(18)8-10/h3-4,7-9H,5-6H2,1-2H3,(H,19,21)
InChIKeyLIZLQGUFZPVSGV-UHFFFAOYSA-N
XLogP3.67
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.22
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(3-ethoxy-4-methoxyphenyl)pyridine-4-carboxamide
CID 60795263
2,6-dichloro-N-[3-chloro-4-[2-(dimethylamino)ethoxy]phenyl]pyridine-4-carboxamide
CID 86964022
3,5-dichloro-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 46427791
4-(4-chlorophenyl)-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]-4-oxobutanamide
CID 32518368
2-(2-aminoethyl)-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]-1,3-thiazole-4-carboxamide
CID 120622378
(2S)-2-amino-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]propanamide
CID 119289355
methyl 4-[(2,6-dichloropyridine-4-carbonyl)amino]benzoate
CID 26098317
3,5-dichloro-4-methoxy-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 46448262
4-N-(3,4-dimethoxyphenyl)-1-N-(3-methoxypropyl)benzene-1,4-dicarboxamide
CID 109045361
2-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-4-carboxamide
CID 60693051
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide
CID 166219863

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
The IUPAC name of 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide (CID 86930838) is 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
The canonical SMILES for 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide is COCCOc1cc(NC(=O)c2cc(Cl)nc(Cl)c2)ccc1OC.
What is the InChIKey of 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
The InChIKey is LIZLQGUFZPVSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O4/c1-22-5-6-24-13-9-11(3-4-12(13)23-2)19-16(21)10-7-14(17)20-15(18)8-10/h3-4,7-9H,5-6H2,1-2H3,(H,19,21).
What are the key properties of 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide?
2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide has a molecular weight of 371.22 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 86930838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).