N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide

C11H10N4OS — CID 2576428

IUPACN-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide
SMILESO=C(Nc1nnc(C2CC2)s1)c1ccncc1
InChIInChI=1S/C11H10N4OS/c16-9(7-3-5-12-6-4-7)13-11-15-14-10(17-11)8-1-2-8/h3-6,8H,1-2H2,(H,13,15,16)
InChIKeyNZTFKOHUTXYYJC-UHFFFAOYSA-N
MW246.29 g/mol
LogP2.06
Rot. Bonds3

About N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide

N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide (PubChem CID 2576428) has the molecular formula C11H10N4OS and a molecular weight of 246.29 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide
PubChem CID2576428
Molecular FormulaC11H10N4OS
Molecular Weight246.29 g/mol
Exact Mass246.06
IUPAC NameN-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide
SMILESO=C(Nc1nnc(C2CC2)s1)c1ccncc1
InChIInChI=1S/C11H10N4OS/c16-9(7-3-5-12-6-4-7)13-11-15-14-10(17-11)8-1-2-8/h3-6,8H,1-2H2,(H,13,15,16)
InChIKeyNZTFKOHUTXYYJC-UHFFFAOYSA-N
XLogP2.06
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 4173511
N-[5-(3-Pyridinyl)-1,3,4-thiadiazol-2-YL]-2-thiophenecarboxamide
CID 1080952
Acetamide, N-(5-(4-pyridyl)-1,3,4-thiadiazol-2-yl)-
CID 19289
N-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide
CID 1447074
6-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 2085604
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methylsulfanylpyridine-3-carboxamide
CID 2558670
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 746692
N-(5-ethyl-1,3,4-thiadiazol-2-yl)nicotinamide
CID 1387083
Allyl-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-amine
CID 1933398
N-(5-ethyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide
CID 659441
N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-3-pyridinecarboxamide
CID 1245352
N'-hydroxy-N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)octanediamide
CID 118716314

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide (CID 2576428) is N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide is O=C(Nc1nnc(C2CC2)s1)c1ccncc1.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide?
The InChIKey is NZTFKOHUTXYYJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4OS/c16-9(7-3-5-12-6-4-7)13-11-15-14-10(17-11)8-1-2-8/h3-6,8H,1-2H2,(H,13,15,16).
What are the key properties of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide?
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide has a molecular weight of 246.29 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 2576428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).