1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine

C11H17N3OS — CID 65279962

IUPAC1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine
SMILESNC1(COc2nc(C3CC3)ns2)CCCC1
InChIInChI=1S/C11H17N3OS/c12-11(5-1-2-6-11)7-15-10-13-9(14-16-10)8-3-4-8/h8H,1-7,12H2
InChIKeyOUGIPSHGMQLLEN-UHFFFAOYSA-N
MW239.34 g/mol
LogP2.07
Rot. Bonds4

About 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine

1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine (PubChem CID 65279962) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine
PubChem CID65279962
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine
SMILESNC1(COc2nc(C3CC3)ns2)CCCC1
InChIInChI=1S/C11H17N3OS/c12-11(5-1-2-6-11)7-15-10-13-9(14-16-10)8-3-4-8/h8H,1-7,12H2
InChIKeyOUGIPSHGMQLLEN-UHFFFAOYSA-N
XLogP2.07
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
The IUPAC name of 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine (CID 65279962) is 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
The canonical SMILES for 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine is NC1(COc2nc(C3CC3)ns2)CCCC1.
What is the InChIKey of 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
The InChIKey is OUGIPSHGMQLLEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c12-11(5-1-2-6-11)7-15-10-13-9(14-16-10)8-3-4-8/h8H,1-7,12H2.
What are the key properties of 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine has a molecular weight of 239.34 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine is sourced from PubChem (CID 65279962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).