5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide

C8H8Cl2N2O2 — CID 130565231

IUPAC5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide
SMILESCONC(=O)c1cc(Cl)c(Cl)nc1C
InChIInChI=1S/C8H8Cl2N2O2/c1-4-5(8(13)12-14-2)3-6(9)7(10)11-4/h3H,1-2H3,(H,12,13)
InChIKeyNRSMHGKFBCAUBJ-UHFFFAOYSA-N
MW235.07 g/mol
LogP1.99
Rot. Bonds2

About 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide

5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide (PubChem CID 130565231) has the molecular formula C8H8Cl2N2O2 and a molecular weight of 235.07 g/mol. Its IUPAC name is 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide
PubChem CID130565231
Molecular FormulaC8H8Cl2N2O2
Molecular Weight235.07 g/mol
Exact Mass234.00
IUPAC Name5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide
SMILESCONC(=O)c1cc(Cl)c(Cl)nc1C
InChIInChI=1S/C8H8Cl2N2O2/c1-4-5(8(13)12-14-2)3-6(9)7(10)11-4/h3H,1-2H3,(H,12,13)
InChIKeyNRSMHGKFBCAUBJ-UHFFFAOYSA-N
XLogP1.99
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.07
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5,6-dichloro-N-methoxy-N,2-dimethylpyridine-3-carboxamide
CID 119054669
5,6-dichloro-N-methoxypyridine-3-carboxamide;ethane
CID 143700585
4-chloro-N-methoxypyridine-3-carboxamide
CID 103871256
3-chloro-N-methoxy-2-methylbenzamide
CID 107097630
5-bromo-2-chloro-N-methoxypyridine-3-carboxamide
CID 103636119
(4-methyl-1,3-thiazol-2-yl)methyl 5,6-dichloro-2-methylpyridine-3-carboxylate
CID 166404542
3-chloro-5-methoxycarbonyl-6-methylpyridine-2-carboxylic acid
CID 162377384
methyl 5,6-dichloro-2-(difluoromethyl)pyridine-3-carboxylate
CID 130099415
N-methoxy-3-methylpyridazine-4-carboxamide
CID 127009551
N-methoxy-2-methylpyridine-3-carboxamide
CID 78950808
6-(3-bromophenyl)-N-methoxy-2-methylpyridine-3-carboxamide
CID 30796992
2-bromo-N-methoxy-6-methylpyridine-3-carboxamide
CID 131155875

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide?
The IUPAC name of 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide (CID 130565231) is 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide.
What is the SMILES notation for 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide?
The canonical SMILES for 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide is CONC(=O)c1cc(Cl)c(Cl)nc1C.
What is the InChIKey of 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide?
The InChIKey is NRSMHGKFBCAUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2N2O2/c1-4-5(8(13)12-14-2)3-6(9)7(10)11-4/h3H,1-2H3,(H,12,13).
What are the key properties of 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide?
5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide has a molecular weight of 235.07 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-N-methoxy-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 130565231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).