2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide

C10H9ClN4OS — CID 114912055

IUPAC2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2cnns2)cc(Cl)n1
InChIInChI=1S/C10H9ClN4OS/c1-2-7-3-6(4-8(11)13-7)10(16)14-9-5-12-15-17-9/h3-5H,2H2,1H3,(H,14,16)
InChIKeyPXMAHOLQMZGUGF-UHFFFAOYSA-N
MW268.73 g/mol
LogP2.40
Rot. Bonds3

About 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide

2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide (PubChem CID 114912055) has the molecular formula C10H9ClN4OS and a molecular weight of 268.73 g/mol. Its IUPAC name is 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
PubChem CID114912055
Molecular FormulaC10H9ClN4OS
Molecular Weight268.73 g/mol
Exact Mass268.02
IUPAC Name2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
SMILESCCc1cc(C(=O)Nc2cnns2)cc(Cl)n1
InChIInChI=1S/C10H9ClN4OS/c1-2-7-3-6(4-8(11)13-7)10(16)14-9-5-12-15-17-9/h3-5H,2H2,1H3,(H,14,16)
InChIKeyPXMAHOLQMZGUGF-UHFFFAOYSA-N
XLogP2.40
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.73
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-6-hydrazinyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 114914420
2-chloro-6-hydrazinyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 114914433
2-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-ethylpyridine-4-carboxamide
CID 107573376
2-chloro-6-ethyl-N-(4-hydroxy-2,5-dimethylphenyl)pyridine-4-carboxamide
CID 106954276
N-(3-bromo-5-methylphenyl)-2-chloro-6-ethylpyridine-4-carboxamide
CID 107582987
2-chloro-6-ethyl-N-(3-methylpentan-3-yl)pyridine-4-carboxamide
CID 114174171
2-(methylamino)-6-propan-2-yl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 114914188
2-chloro-6-ethyl-N-[(2-methylpropan-2-yl)oxy]pyridine-4-carboxamide
CID 107856458
2-chloro-6-ethyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-4-carboxamide
CID 116786621
3-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(thiadiazol-5-yl)benzamide
CID 114913575
3-bromo-4-chloro-N-(thiadiazol-5-yl)benzamide
CID 103282570
4-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(thiadiazol-5-yl)benzamide
CID 114913573

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide (CID 114912055) is 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide is CCc1cc(C(=O)Nc2cnns2)cc(Cl)n1.
What is the InChIKey of 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
The InChIKey is PXMAHOLQMZGUGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4OS/c1-2-7-3-6(4-8(11)13-7)10(16)14-9-5-12-15-17-9/h3-5H,2H2,1H3,(H,14,16).
What are the key properties of 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide has a molecular weight of 268.73 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-ethyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide is sourced from PubChem (CID 114912055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).