N-(2-hydroxyethyl)thiadiazole-5-carboxamide

C5H7N3O2S — CID 43522680

IUPACN-(2-hydroxyethyl)thiadiazole-5-carboxamide
SMILESO=C(NCCO)c1cnns1
InChIInChI=1S/C5H7N3O2S/c9-2-1-6-5(10)4-3-7-8-11-4/h3,9H,1-2H2,(H,6,10)
InChIKeyCAVLPOJWGUJKBY-UHFFFAOYSA-N
MW173.20 g/mol
LogP-0.74
Rot. Bonds3

About N-(2-hydroxyethyl)thiadiazole-5-carboxamide

N-(2-hydroxyethyl)thiadiazole-5-carboxamide (PubChem CID 43522680) has the molecular formula C5H7N3O2S and a molecular weight of 173.20 g/mol. Its IUPAC name is N-(2-hydroxyethyl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)thiadiazole-5-carboxamide
PubChem CID43522680
Molecular FormulaC5H7N3O2S
Molecular Weight173.20 g/mol
Exact Mass173.03
IUPAC NameN-(2-hydroxyethyl)thiadiazole-5-carboxamide
SMILESO=C(NCCO)c1cnns1
InChIInChI=1S/C5H7N3O2S/c9-2-1-6-5(10)4-3-7-8-11-4/h3,9H,1-2H2,(H,6,10)
InChIKeyCAVLPOJWGUJKBY-UHFFFAOYSA-N
XLogP-0.74
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.20
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)thiadiazole-5-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)thiadiazole-5-carboxamide (CID 43522680) is N-(2-hydroxyethyl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)thiadiazole-5-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)thiadiazole-5-carboxamide is O=C(NCCO)c1cnns1.
What is the InChIKey of N-(2-hydroxyethyl)thiadiazole-5-carboxamide?
The InChIKey is CAVLPOJWGUJKBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O2S/c9-2-1-6-5(10)4-3-7-8-11-4/h3,9H,1-2H2,(H,6,10).
What are the key properties of N-(2-hydroxyethyl)thiadiazole-5-carboxamide?
N-(2-hydroxyethyl)thiadiazole-5-carboxamide has a molecular weight of 173.20 g/mol, XLogP of -0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)thiadiazole-5-carboxamide is sourced from PubChem (CID 43522680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).