N-cyclopropylthiadiazole-4-carboxamide

C6H7N3OS — CID 35762597

IUPACN-cyclopropylthiadiazole-4-carboxamide
SMILESO=C(NC1CC1)c1csnn1
InChIInChI=1S/C6H7N3OS/c10-6(7-4-1-2-4)5-3-11-9-8-5/h3-4H,1-2H2,(H,7,10)
InChIKeyAMXQLRLURSSQIR-UHFFFAOYSA-N
MW169.21 g/mol
LogP0.43
Rot. Bonds2

About N-cyclopropylthiadiazole-4-carboxamide

N-cyclopropylthiadiazole-4-carboxamide (PubChem CID 35762597) has the molecular formula C6H7N3OS and a molecular weight of 169.21 g/mol. Its IUPAC name is N-cyclopropylthiadiazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropylthiadiazole-4-carboxamide
PubChem CID35762597
Molecular FormulaC6H7N3OS
Molecular Weight169.21 g/mol
Exact Mass169.03
IUPAC NameN-cyclopropylthiadiazole-4-carboxamide
SMILESO=C(NC1CC1)c1csnn1
InChIInChI=1S/C6H7N3OS/c10-6(7-4-1-2-4)5-3-11-9-8-5/h3-4H,1-2H2,(H,7,10)
InChIKeyAMXQLRLURSSQIR-UHFFFAOYSA-N
XLogP0.43
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.21
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropylthiadiazole-4-carboxamide?
The IUPAC name of N-cyclopropylthiadiazole-4-carboxamide (CID 35762597) is N-cyclopropylthiadiazole-4-carboxamide.
What is the SMILES notation for N-cyclopropylthiadiazole-4-carboxamide?
The canonical SMILES for N-cyclopropylthiadiazole-4-carboxamide is O=C(NC1CC1)c1csnn1.
What is the InChIKey of N-cyclopropylthiadiazole-4-carboxamide?
The InChIKey is AMXQLRLURSSQIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3OS/c10-6(7-4-1-2-4)5-3-11-9-8-5/h3-4H,1-2H2,(H,7,10).
What are the key properties of N-cyclopropylthiadiazole-4-carboxamide?
N-cyclopropylthiadiazole-4-carboxamide has a molecular weight of 169.21 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropylthiadiazole-4-carboxamide is sourced from PubChem (CID 35762597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).