N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide

C8H5ClN4OS — CID 103622836

IUPACN-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide
SMILESO=C(Nc1cccnc1Cl)c1cnns1
InChIInChI=1S/C8H5ClN4OS/c9-7-5(2-1-3-10-7)12-8(14)6-4-11-13-15-6/h1-4H,(H,12,14)
InChIKeyHJMGEPYYQKGEQK-UHFFFAOYSA-N
MW240.68 g/mol
LogP1.84
Rot. Bonds2

About N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide

N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide (PubChem CID 103622836) has the molecular formula C8H5ClN4OS and a molecular weight of 240.68 g/mol. Its IUPAC name is N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide
PubChem CID103622836
Molecular FormulaC8H5ClN4OS
Molecular Weight240.68 g/mol
Exact Mass239.99
IUPAC NameN-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide
SMILESO=C(Nc1cccnc1Cl)c1cnns1
InChIInChI=1S/C8H5ClN4OS/c9-7-5(2-1-3-10-7)12-8(14)6-4-11-13-15-6/h1-4H,(H,12,14)
InChIKeyHJMGEPYYQKGEQK-UHFFFAOYSA-N
XLogP1.84
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.68
LogP ≤ 51.84
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-chloro-N-(2-chloro-3-pyridinyl)benzamide
CID 4245221
N-(3-hydroxy-2-methylphenyl)thiadiazole-5-carboxamide
CID 65215255
N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide
CID 103719575
N-(2-chloro-3-pyridinyl)-2-(methylamino)benzamide
CID 61375906
N-(6-chloro-2-pyridinyl)thiadiazole-5-carboxamide
CID 115683223
2-acetamido-N-(2-chloro-3-pyridinyl)benzamide
CID 13143772
2-amino-N-(2-chloro-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 62789087
5-chloro-2-(thiadiazole-5-carbonylamino)benzoic acid
CID 43522632
N-(2-chloro-3-pyridinyl)-4-pyridin-3-ylbenzamide
CID 59673856
N-(2-chloro-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 17253103
N-(2-chloro-3-pyridinyl)-3,4,5-trifluorobenzamide
CID 63188572
2,4-dichloro-N-(2-chloro-3-pyridinyl)benzamide
CID 3454315

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide?
The IUPAC name of N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide (CID 103622836) is N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide?
The canonical SMILES for N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide is O=C(Nc1cccnc1Cl)c1cnns1.
What is the InChIKey of N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide?
The InChIKey is HJMGEPYYQKGEQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClN4OS/c9-7-5(2-1-3-10-7)12-8(14)6-4-11-13-15-6/h1-4H,(H,12,14).
What are the key properties of N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide?
N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide has a molecular weight of 240.68 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide is sourced from PubChem (CID 103622836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).