2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol

C10H17N3OS — CID 65273392

IUPAC2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol
SMILESCc1nsc(N(CCO)C2CCCC2)n1
InChIInChI=1S/C10H17N3OS/c1-8-11-10(15-12-8)13(6-7-14)9-4-2-3-5-9/h9,14H,2-7H2,1H3
InChIKeyJTEQUZGQOYEXMG-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.59
Rot. Bonds4

About 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol

2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol (PubChem CID 65273392) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol
PubChem CID65273392
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol
SMILESCc1nsc(N(CCO)C2CCCC2)n1
InChIInChI=1S/C10H17N3OS/c1-8-11-10(15-12-8)13(6-7-14)9-4-2-3-5-9/h9,14H,2-7H2,1H3
InChIKeyJTEQUZGQOYEXMG-UHFFFAOYSA-N
XLogP1.59
TPSA49.25 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 ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
The IUPAC name of 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol (CID 65273392) is 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol.
What is the SMILES notation for 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
The canonical SMILES for 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol is Cc1nsc(N(CCO)C2CCCC2)n1.
What is the InChIKey of 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
The InChIKey is JTEQUZGQOYEXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-8-11-10(15-12-8)13(6-7-14)9-4-2-3-5-9/h9,14H,2-7H2,1H3.
What are the key properties of 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol has a molecular weight of 227.33 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol is sourced from PubChem (CID 65273392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).