N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide

C10H15N3OS — CID 38653497

IUPACN-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)NCC1CCC1
InChIInChI=1S/C10H15N3OS/c1-2-8-9(15-13-12-8)10(14)11-6-7-4-3-5-7/h7H,2-6H2,1H3,(H,11,14)
InChIKeyOOMYFRUYWBIDOD-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.63
Rot. Bonds4

About N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide

N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide (PubChem CID 38653497) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide
PubChem CID38653497
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC NameN-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)NCC1CCC1
InChIInChI=1S/C10H15N3OS/c1-2-8-9(15-13-12-8)10(14)11-6-7-4-3-5-7/h7H,2-6H2,1H3,(H,11,14)
InChIKeyOOMYFRUYWBIDOD-UHFFFAOYSA-N
XLogP1.63
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide (CID 38653497) is N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide is CCc1nnsc1C(=O)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide?
The InChIKey is OOMYFRUYWBIDOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-2-8-9(15-13-12-8)10(14)11-6-7-4-3-5-7/h7H,2-6H2,1H3,(H,11,14).
What are the key properties of N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide?
N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide has a molecular weight of 225.32 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-4-ethylthiadiazole-5-carboxamide is sourced from PubChem (CID 38653497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).