2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide

C8H10FN3OS — CID 126794162

IUPAC2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide
SMILESCc1nnc(NC(=O)C2(C)CC2F)s1
InChIInChI=1S/C8H10FN3OS/c1-4-11-12-7(14-4)10-6(13)8(2)3-5(8)9/h5H,3H2,1-2H3,(H,10,12,13)
InChIKeySHAWLYDYHXHFFS-UHFFFAOYSA-N
MW215.25 g/mol
LogP1.53
Rot. Bonds2

About 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide

2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide (PubChem CID 126794162) has the molecular formula C8H10FN3OS and a molecular weight of 215.25 g/mol. Its IUPAC name is 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide
PubChem CID126794162
Molecular FormulaC8H10FN3OS
Molecular Weight215.25 g/mol
Exact Mass215.05
IUPAC Name2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide
SMILESCc1nnc(NC(=O)C2(C)CC2F)s1
InChIInChI=1S/C8H10FN3OS/c1-4-11-12-7(14-4)10-6(13)8(2)3-5(8)9/h5H,3H2,1-2H3,(H,10,12,13)
InChIKeySHAWLYDYHXHFFS-UHFFFAOYSA-N
XLogP1.53
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide (CID 126794162) is 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide is Cc1nnc(NC(=O)C2(C)CC2F)s1.
What is the InChIKey of 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide?
The InChIKey is SHAWLYDYHXHFFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3OS/c1-4-11-12-7(14-4)10-6(13)8(2)3-5(8)9/h5H,3H2,1-2H3,(H,10,12,13).
What are the key properties of 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide?
2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide has a molecular weight of 215.25 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 126794162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).