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

C8H11N3OS — CID 130711107

IUPAC(1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide
SMILESCC1(C)C[C@@H]1C(=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)/t5-/m1/s1
InChIKeyJNDYTGJGBYZFKO-RXMQYKEDSA-N
MW197.26 g/mol
LogP1.52
Rot. Bonds2

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

(1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide (PubChem CID 130711107) has the molecular formula C8H11N3OS and a molecular weight of 197.26 g/mol. Its IUPAC name is (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name(1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide
PubChem CID130711107
Molecular FormulaC8H11N3OS
Molecular Weight197.26 g/mol
Exact Mass197.06
IUPAC Name(1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide
SMILESCC1(C)C[C@@H]1C(=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)/t5-/m1/s1
InChIKeyJNDYTGJGBYZFKO-RXMQYKEDSA-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 (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
The IUPAC name of (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide (CID 130711107) is (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
The canonical SMILES for (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide is CC1(C)C[C@@H]1C(=O)Nc1cnns1.
What is the InChIKey of (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
The InChIKey is JNDYTGJGBYZFKO-RXMQYKEDSA-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)/t5-/m1/s1.
What are the key properties of (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide?
(1S)-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 (1S)-2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 130711107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).