3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole

C10H15N3S — CID 127417883

IUPAC3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole
SMILESC1CCN(c2nc(C3CC3)ns2)CC1
InChIInChI=1S/C10H15N3S/c1-2-6-13(7-3-1)10-11-9(12-14-10)8-4-5-8/h8H,1-7H2
InChIKeyKUZKCLPXPIIKQT-UHFFFAOYSA-N
MW209.32 g/mol
LogP2.41
Rot. Bonds2

About 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole

3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole (PubChem CID 127417883) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole.

Molecular Properties

Compound Name3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole
PubChem CID127417883
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC Name3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole
SMILESC1CCN(c2nc(C3CC3)ns2)CC1
InChIInChI=1S/C10H15N3S/c1-2-6-13(7-3-1)10-11-9(12-14-10)8-4-5-8/h8H,1-7H2
InChIKeyKUZKCLPXPIIKQT-UHFFFAOYSA-N
XLogP2.41
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.32
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole?
The IUPAC name of 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole (CID 127417883) is 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole.
What is the SMILES notation for 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole?
The canonical SMILES for 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole is C1CCN(c2nc(C3CC3)ns2)CC1.
What is the InChIKey of 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole?
The InChIKey is KUZKCLPXPIIKQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c1-2-6-13(7-3-1)10-11-9(12-14-10)8-4-5-8/h8H,1-7H2.
What are the key properties of 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole?
3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole has a molecular weight of 209.32 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-piperidin-1-yl-1,2,4-thiadiazole is sourced from PubChem (CID 127417883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).