4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine

C16H28N4O2S — CID 84585899

IUPAC4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine
SMILESCC(C)c1nsc(N2CCC(OCCN3CCOCC3)CC2)n1
InChIInChI=1S/C16H28N4O2S/c1-13(2)15-17-16(23-18-15)20-5-3-14(4-6-20)22-12-9-19-7-10-21-11-8-19/h13-14H,3-12H2,1-2H3
InChIKeyKPLKDATXCZYQAQ-UHFFFAOYSA-N
MW340.49 g/mol
LogP1.98
Rot. Bonds6

About 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine

4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine (PubChem CID 84585899) has the molecular formula C16H28N4O2S and a molecular weight of 340.49 g/mol. Its IUPAC name is 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine
PubChem CID84585899
Molecular FormulaC16H28N4O2S
Molecular Weight340.49 g/mol
Exact Mass340.19
IUPAC Name4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine
SMILESCC(C)c1nsc(N2CCC(OCCN3CCOCC3)CC2)n1
InChIInChI=1S/C16H28N4O2S/c1-13(2)15-17-16(23-18-15)20-5-3-14(4-6-20)22-12-9-19-7-10-21-11-8-19/h13-14H,3-12H2,1-2H3
InChIKeyKPLKDATXCZYQAQ-UHFFFAOYSA-N
XLogP1.98
TPSA50.72 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.49
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methyl-4-[3-(2-methylpropyl)-1,2,4-thiadiazol-5-yl]-3,4a,5,7,8,8a-hexahydro-2H-pyrido[4,3-b][1,4]oxazine
CID 121556130
(2S)-4-(3-ethyl-1,2,4-thiadiazol-5-yl)-2-(morpholin-4-ylmethyl)morpholine
CID 164640503
N-(2-piperidin-4-yloxyethyl)-3-propan-2-yl-1,2,4-thiadiazol-5-amine
CID 65275898
4-(3-Ethyl-1,2,4-thiadiazol-5-yl)-2,6-dimethylmorpholine
CID 71866358
4-(3-Cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine
CID 71925340
2,6-Dimethyl-4-[2-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]ethyl]morpholine
CID 71976810
2-[1-(3-Propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]oxyethanol
CID 75376989
4-(3-Propan-2-yl-1,2,4-thiadiazol-5-yl)morpholine-2-carbonitrile
CID 79674812
3-[1-(3-Propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxypropan-1-amine
CID 79737224
2-[1-(3-Propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethanamine
CID 82692054
2-[1-(3-Tert-butyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethanamine
CID 82692166
2-[1-(3-Methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethanamine
CID 82693043

Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine?
The IUPAC name of 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine (CID 84585899) is 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine.
What is the SMILES notation for 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine?
The canonical SMILES for 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine is CC(C)c1nsc(N2CCC(OCCN3CCOCC3)CC2)n1.
What is the InChIKey of 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine?
The InChIKey is KPLKDATXCZYQAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O2S/c1-13(2)15-17-16(23-18-15)20-5-3-14(4-6-20)22-12-9-19-7-10-21-11-8-19/h13-14H,3-12H2,1-2H3.
What are the key properties of 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine?
4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine has a molecular weight of 340.49 g/mol, XLogP of 1.98, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine is sourced from PubChem (CID 84585899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).