2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide

C8H11N3OS — CID 130977857

IUPAC2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)Nc1cnns1
InChIInChI=1S/C8H11N3OS/c1-8(2)3-5(8)7(12)10-6-4-9-11-13-6/h4-5H,3H2,1-2H3,(H,10,12)
InChIKeyJNDYTGJGBYZFKO-UHFFFAOYSA-N
MW197.26 g/mol
LogP1.52
Rot. Bonds2

About 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide

2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide (PubChem CID 130977857) has the molecular formula C8H11N3OS and a molecular weight of 197.26 g/mol. Its IUPAC name is 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide
PubChem CID130977857
Molecular FormulaC8H11N3OS
Molecular Weight197.26 g/mol
Exact Mass197.06
IUPAC Name2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)Nc1cnns1
InChIInChI=1S/C8H11N3OS/c1-8(2)3-5(8)7(12)10-6-4-9-11-13-6/h4-5H,3H2,1-2H3,(H,10,12)
InChIKeyJNDYTGJGBYZFKO-UHFFFAOYSA-N
XLogP1.52
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
The IUPAC name of 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide (CID 130977857) is 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide is CC1(C)CC1C(=O)Nc1cnns1.
What is the InChIKey of 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
The InChIKey is JNDYTGJGBYZFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3OS/c1-8(2)3-5(8)7(12)10-6-4-9-11-13-6/h4-5H,3H2,1-2H3,(H,10,12).
What are the key properties of 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide has a molecular weight of 197.26 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 130977857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).