2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide

C15H13Cl2N3O3 — CID 1265401

IUPAC2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)NC(=O)c2c(C)cc(Cl)nc2Cl)c1
InChIInChI=1S/C15H13Cl2N3O3/c1-8-6-11(16)19-13(17)12(8)14(21)20-15(22)18-9-4-3-5-10(7-9)23-2/h3-7H,1-2H3,(H2,18,20,21,22)
InChIKeyLORZNZKBPNDVNS-UHFFFAOYSA-N
MW354.19 g/mol
LogP3.67
Rot. Bonds3

About 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide

2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide (PubChem CID 1265401) has the molecular formula C15H13Cl2N3O3 and a molecular weight of 354.19 g/mol. Its IUPAC name is 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide
PubChem CID1265401
Molecular FormulaC15H13Cl2N3O3
Molecular Weight354.19 g/mol
Exact Mass353.03
IUPAC Name2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)NC(=O)c2c(C)cc(Cl)nc2Cl)c1
InChIInChI=1S/C15H13Cl2N3O3/c1-8-6-11(16)19-13(17)12(8)14(21)20-15(22)18-9-4-3-5-10(7-9)23-2/h3-7H,1-2H3,(H2,18,20,21,22)
InChIKeyLORZNZKBPNDVNS-UHFFFAOYSA-N
XLogP3.67
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.19
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(3-Methoxy-phenylamino)-4,6-dimethyl-nicotinamide
CID 847091
2,4,5,6-tetrachloro-N-(2,5-dimethoxyphenyl)pyridine-3-carboxamide
CID 1046217
2,4,5,6-tetrachloro-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 1044959
6-Chloro-N-(3-methoxyphenyl)nicotinamide
CID 18419424
2,4,6-trichloro-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 579068
2,5-Dichloro-N-(4-methoxy-phenyl)-4,6-dimethyl-nicotinamide
CID 608822
2,6-dichloro-N-(4-methoxyphenyl)-4-methylpyridine-3-carboxamide
CID 685922
2,5-dichloro-N-(3-methoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
CID 778134
2,6-dichloro-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 34753478
2,6-dichloro-5-fluoro-N-(3-methoxyphenyl)nicotinamide
CID 850419
2-chloro-N-(3-ethoxyphenyl)pyridine-3-carboxamide
CID 61042110
2-chloro-N-(3-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 76320109

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide?
The IUPAC name of 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide (CID 1265401) is 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide.
What is the SMILES notation for 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide?
The canonical SMILES for 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide is COc1cccc(NC(=O)NC(=O)c2c(C)cc(Cl)nc2Cl)c1.
What is the InChIKey of 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide?
The InChIKey is LORZNZKBPNDVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2N3O3/c1-8-6-11(16)19-13(17)12(8)14(21)20-15(22)18-9-4-3-5-10(7-9)23-2/h3-7H,1-2H3,(H2,18,20,21,22).
What are the key properties of 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide?
2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide has a molecular weight of 354.19 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[(3-methoxyphenyl)carbamoyl]-4-methylpyridine-3-carboxamide is sourced from PubChem (CID 1265401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).