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

C9H15N3OS — CID 65267755

IUPAC[1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol
SMILESCc1nsc(NC2(CO)CCCC2)n1
InChIInChI=1S/C9H15N3OS/c1-7-10-8(14-12-7)11-9(6-13)4-2-3-5-9/h13H,2-6H2,1H3,(H,10,11,12)
InChIKeyQAKBKMYMKKTXOE-UHFFFAOYSA-N
MW213.31 g/mol
LogP1.56
Rot. Bonds3

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

[1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol (PubChem CID 65267755) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol
PubChem CID65267755
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name[1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol
SMILESCc1nsc(NC2(CO)CCCC2)n1
InChIInChI=1S/C9H15N3OS/c1-7-10-8(14-12-7)11-9(6-13)4-2-3-5-9/h13H,2-6H2,1H3,(H,10,11,12)
InChIKeyQAKBKMYMKKTXOE-UHFFFAOYSA-N
XLogP1.56
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol?
The IUPAC name of [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol (CID 65267755) is [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol is Cc1nsc(NC2(CO)CCCC2)n1.
What is the InChIKey of [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol?
The InChIKey is QAKBKMYMKKTXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-7-10-8(14-12-7)11-9(6-13)4-2-3-5-9/h13H,2-6H2,1H3,(H,10,11,12).
What are the key properties of [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol?
[1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol has a molecular weight of 213.31 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 65267755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).