4-(3-cyclopentylazetidin-2-yl)thiadiazole

C10H15N3S — CID 131162568

IUPAC4-(3-cyclopentylazetidin-2-yl)thiadiazole
SMILESc1snnc1C1NCC1C1CCCC1
InChIInChI=1S/C10H15N3S/c1-2-4-7(3-1)8-5-11-10(8)9-6-14-13-12-9/h6-8,10-11H,1-5H2
InChIKeyRBHHKLLYBJIOBJ-UHFFFAOYSA-N
MW209.32 g/mol
LogP1.99
Rot. Bonds2

About 4-(3-cyclopentylazetidin-2-yl)thiadiazole

4-(3-cyclopentylazetidin-2-yl)thiadiazole (PubChem CID 131162568) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is 4-(3-cyclopentylazetidin-2-yl)thiadiazole.

Molecular Properties

Compound Name4-(3-cyclopentylazetidin-2-yl)thiadiazole
PubChem CID131162568
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC Name4-(3-cyclopentylazetidin-2-yl)thiadiazole
SMILESc1snnc1C1NCC1C1CCCC1
InChIInChI=1S/C10H15N3S/c1-2-4-7(3-1)8-5-11-10(8)9-6-14-13-12-9/h6-8,10-11H,1-5H2
InChIKeyRBHHKLLYBJIOBJ-UHFFFAOYSA-N
XLogP1.99
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.32
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylazetidin-2-yl)thiadiazole?
The IUPAC name of 4-(3-cyclopentylazetidin-2-yl)thiadiazole (CID 131162568) is 4-(3-cyclopentylazetidin-2-yl)thiadiazole.
What is the SMILES notation for 4-(3-cyclopentylazetidin-2-yl)thiadiazole?
The canonical SMILES for 4-(3-cyclopentylazetidin-2-yl)thiadiazole is c1snnc1C1NCC1C1CCCC1.
What is the InChIKey of 4-(3-cyclopentylazetidin-2-yl)thiadiazole?
The InChIKey is RBHHKLLYBJIOBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c1-2-4-7(3-1)8-5-11-10(8)9-6-14-13-12-9/h6-8,10-11H,1-5H2.
What are the key properties of 4-(3-cyclopentylazetidin-2-yl)thiadiazole?
4-(3-cyclopentylazetidin-2-yl)thiadiazole has a molecular weight of 209.32 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylazetidin-2-yl)thiadiazole is sourced from PubChem (CID 131162568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).