2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide

C11H15N3OS — CID 51073156

IUPAC2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(CC1CC2CCC1C2)Nc1nncs1
InChIInChI=1S/C11H15N3OS/c15-10(13-11-14-12-6-16-11)5-9-4-7-1-2-8(9)3-7/h6-9H,1-5H2,(H,13,14,15)
InChIKeyFSCYRADAFZYUQZ-UHFFFAOYSA-N
MW237.33 g/mol
LogP2.30
Rot. Bonds3

About 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide

2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 51073156) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide
PubChem CID51073156
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(CC1CC2CCC1C2)Nc1nncs1
InChIInChI=1S/C11H15N3OS/c15-10(13-11-14-12-6-16-11)5-9-4-7-1-2-8(9)3-7/h6-9H,1-5H2,(H,13,14,15)
InChIKeyFSCYRADAFZYUQZ-UHFFFAOYSA-N
XLogP2.30
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide (CID 51073156) is 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide is O=C(CC1CC2CCC1C2)Nc1nncs1.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is FSCYRADAFZYUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c15-10(13-11-14-12-6-16-11)5-9-4-7-1-2-8(9)3-7/h6-9H,1-5H2,(H,13,14,15).
What are the key properties of 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 237.33 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanyl)-N-(1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 51073156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).