2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol

C11H19N3OS — CID 115753001

IUPAC2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol
SMILESOCCN(Cc1csnn1)C1CCCCC1
InChIInChI=1S/C11H19N3OS/c15-7-6-14(8-10-9-16-13-12-10)11-4-2-1-3-5-11/h9,11,15H,1-8H2
InChIKeyRCPBDTDRFVILAY-UHFFFAOYSA-N
MW241.36 g/mol
LogP1.67
Rot. Bonds5

About 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol

2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol (PubChem CID 115753001) has the molecular formula C11H19N3OS and a molecular weight of 241.36 g/mol. Its IUPAC name is 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol
PubChem CID115753001
Molecular FormulaC11H19N3OS
Molecular Weight241.36 g/mol
Exact Mass241.12
IUPAC Name2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol
SMILESOCCN(Cc1csnn1)C1CCCCC1
InChIInChI=1S/C11H19N3OS/c15-7-6-14(8-10-9-16-13-12-10)11-4-2-1-3-5-11/h9,11,15H,1-8H2
InChIKeyRCPBDTDRFVILAY-UHFFFAOYSA-N
XLogP1.67
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol 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 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol?
The IUPAC name of 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol (CID 115753001) is 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol is OCCN(Cc1csnn1)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol?
The InChIKey is RCPBDTDRFVILAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3OS/c15-7-6-14(8-10-9-16-13-12-10)11-4-2-1-3-5-11/h9,11,15H,1-8H2.
What are the key properties of 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol?
2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol has a molecular weight of 241.36 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(thiadiazol-4-ylmethyl)amino]ethanol is sourced from PubChem (CID 115753001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).