5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide

C10H12Cl2N2O2 — CID 82723834

IUPAC5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
SMILESCC(C)(C)ONC(=O)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C10H12Cl2N2O2/c1-10(2,3)16-14-9(15)6-4-7(11)8(12)13-5-6/h4-5H,1-3H3,(H,14,15)
InChIKeyRDMJEQUQDQDRIU-UHFFFAOYSA-N
MW263.12 g/mol
LogP2.85
Rot. Bonds2

About 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide

5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide (PubChem CID 82723834) has the molecular formula C10H12Cl2N2O2 and a molecular weight of 263.12 g/mol. Its IUPAC name is 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
PubChem CID82723834
Molecular FormulaC10H12Cl2N2O2
Molecular Weight263.12 g/mol
Exact Mass262.03
IUPAC Name5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
SMILESCC(C)(C)ONC(=O)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C10H12Cl2N2O2/c1-10(2,3)16-14-9(15)6-4-7(11)8(12)13-5-6/h4-5H,1-3H3,(H,14,15)
InChIKeyRDMJEQUQDQDRIU-UHFFFAOYSA-N
XLogP2.85
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.12
LogP ≤ 52.85
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-methoxypyridine-3-carboxamide;ethane
CID 143700585
N-(3-amino-2,2-dimethyl-3-oxopropyl)-5,6-dichloropyridine-3-carboxamide
CID 113226390
2-[(2-methylpropan-2-yl)oxy]ethyl 5,6-dichloropyridine-3-carboxylate
CID 112686977
6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
CID 82723958
4-chloro-3-hydroxy-N-[(2-methylpropan-2-yl)oxy]benzamide
CID 57437880
N-[2-(carbamoylamino)ethyl]-5,6-dichloropyridine-3-carboxamide
CID 78995207
5,6-dichloro-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)pyridine-3-carboxamide
CID 113239579
5,6-dichloro-N-(2-methyl-2-phenylpropyl)pyridine-3-carboxamide
CID 60748585
5,6-dichloro-N-(2,4,5-trichlorophenyl)pyridine-3-carboxamide
CID 27687750
5,6-dichloro-N-(3-methylsulfanylpropyl)pyridine-3-carboxamide
CID 63964074
5,6-dichloro-N-[(2R)-1-hydroxypropan-2-yl]pyridine-3-carboxamide
CID 79027668
5,6-dichloro-N-(1-methylcyclopentyl)pyridine-3-carboxamide
CID 61367940

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The IUPAC name of 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide (CID 82723834) is 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide.
What is the SMILES notation for 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The canonical SMILES for 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide is CC(C)(C)ONC(=O)c1cnc(Cl)c(Cl)c1.
What is the InChIKey of 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The InChIKey is RDMJEQUQDQDRIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2O2/c1-10(2,3)16-14-9(15)6-4-7(11)8(12)13-5-6/h4-5H,1-3H3,(H,14,15).
What are the key properties of 5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
5,6-dichloro-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide has a molecular weight of 263.12 g/mol, XLogP of 2.85, 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-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide is sourced from PubChem (CID 82723834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).