1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol

C8H13N3OS — CID 65274465

IUPAC1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNc2ncns2)CCCC1
InChIInChI=1S/C8H13N3OS/c12-8(3-1-2-4-8)5-9-7-10-6-11-13-7/h6,12H,1-5H2,(H,9,10,11)
InChIKeyOYKFQKKGJMDRJJ-UHFFFAOYSA-N
MW199.28 g/mol
LogP1.26
Rot. Bonds3

About 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol

1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol (PubChem CID 65274465) has the molecular formula C8H13N3OS and a molecular weight of 199.28 g/mol. Its IUPAC name is 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol
PubChem CID65274465
Molecular FormulaC8H13N3OS
Molecular Weight199.28 g/mol
Exact Mass199.08
IUPAC Name1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNc2ncns2)CCCC1
InChIInChI=1S/C8H13N3OS/c12-8(3-1-2-4-8)5-9-7-10-6-11-13-7/h6,12H,1-5H2,(H,9,10,11)
InChIKeyOYKFQKKGJMDRJJ-UHFFFAOYSA-N
XLogP1.26
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol (CID 65274465) is 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol is OC1(CNc2ncns2)CCCC1.
What is the InChIKey of 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is OYKFQKKGJMDRJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3OS/c12-8(3-1-2-4-8)5-9-7-10-6-11-13-7/h6,12H,1-5H2,(H,9,10,11).
What are the key properties of 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol?
1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 199.28 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1,2,4-thiadiazol-5-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 65274465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).