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

C10H17N3OS — CID 65279961

IUPAC1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine
SMILESCCc1nsc(OCC2(N)CCCC2)n1
InChIInChI=1S/C10H17N3OS/c1-2-8-12-9(15-13-8)14-7-10(11)5-3-4-6-10/h2-7,11H2,1H3
InChIKeyXMXFAZHXIOQUOM-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.75
Rot. Bonds4

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

1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine (PubChem CID 65279961) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine
PubChem CID65279961
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine
SMILESCCc1nsc(OCC2(N)CCCC2)n1
InChIInChI=1S/C10H17N3OS/c1-2-8-12-9(15-13-8)14-7-10(11)5-3-4-6-10/h2-7,11H2,1H3
InChIKeyXMXFAZHXIOQUOM-UHFFFAOYSA-N
XLogP1.75
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
The IUPAC name of 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine (CID 65279961) is 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
The canonical SMILES for 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine is CCc1nsc(OCC2(N)CCCC2)n1.
What is the InChIKey of 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
The InChIKey is XMXFAZHXIOQUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-2-8-12-9(15-13-8)14-7-10(11)5-3-4-6-10/h2-7,11H2,1H3.
What are the key properties of 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine?
1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine has a molecular weight of 227.33 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-ethyl-1,2,4-thiadiazol-5-yl)oxymethyl]cyclopentan-1-amine is sourced from PubChem (CID 65279961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).