N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide

C6H4Cl2N2O2 — CID 139387572

IUPACN,5-dichloro-6-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NCl)c1ccc(Cl)c(=O)[nH]1
InChIInChI=1S/C6H4Cl2N2O2/c7-3-1-2-4(6(12)10-8)9-5(3)11/h1-2H,(H,9,11)(H,10,12)
InChIKeyCIRVSNUNLLUZBQ-UHFFFAOYSA-N
MW207.02 g/mol
LogP0.91
Rot. Bonds1

About N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide

N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 139387572) has the molecular formula C6H4Cl2N2O2 and a molecular weight of 207.02 g/mol. Its IUPAC name is N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN,5-dichloro-6-oxo-1H-pyridine-2-carboxamide
PubChem CID139387572
Molecular FormulaC6H4Cl2N2O2
Molecular Weight207.02 g/mol
Exact Mass205.96
IUPAC NameN,5-dichloro-6-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NCl)c1ccc(Cl)c(=O)[nH]1
InChIInChI=1S/C6H4Cl2N2O2/c7-3-1-2-4(6(12)10-8)9-5(3)11/h1-2H,(H,9,11)(H,10,12)
InChIKeyCIRVSNUNLLUZBQ-UHFFFAOYSA-N
XLogP0.91
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.02
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-Chloro-6-oxo-1,6-dihydropyridine-2-carboxamide
CID 73554988
5-Chloro-6-oxo-1,6-dihydropyridine-2-carboxamide
CID 118598949
CID 163699501
CID 163699501
5-chloro-N-methylidene-6-oxo-1H-pyridine-2-carboxamide
CID 163974165
(5-chloro-6-oxo-1H-pyridine-2-carbonyl)azanium
CID 164074236
3-chloro-5-iodo-6-oxo-1H-pyridine-2-carboxamide
CID 170359887
1-Chloro-6-oxopyridine-2-carboxamide
CID 174852258
N-(4,6-dichloro-2-oxo-1H-pyridin-3-yl)acetamide
CID 23242570
3-amino-5-chloro-6-methylpyridin-2(1H)-one
CID 105431111
5-amino-6-oxo-1H-pyridine-2-carboxamide
CID 114408741
3,5-Dichloro-6-oxo-1,6-dihydropyridine-2-carboxamide
CID 145710472

Frequently Asked Questions

What is the IUPAC name of N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide (CID 139387572) is N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide is O=C(NCl)c1ccc(Cl)c(=O)[nH]1.
What is the InChIKey of N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is CIRVSNUNLLUZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl2N2O2/c7-3-1-2-4(6(12)10-8)9-5(3)11/h1-2H,(H,9,11)(H,10,12).
What are the key properties of N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide?
N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 207.02 g/mol, XLogP of 0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dichloro-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 139387572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).