2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide

C20H25N5O4S — CID 5298728

IUPAC2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide
SMILESO=C(COc1nsnc1N1CCOCC1)Nc1ccc(C(=O)N2CCCCC2)cc1
InChIInChI=1S/C20H25N5O4S/c26-17(14-29-19-18(22-30-23-19)24-10-12-28-13-11-24)21-16-6-4-15(5-7-16)20(27)25-8-2-1-3-9-25/h4-7H,1-3,8-14H2,(H,21,26)
InChIKeyKWKLCKKLHYHRMV-UHFFFAOYSA-N
MW431.52 g/mol
LogP2.02
Rot. Bonds6

About 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide

2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide (PubChem CID 5298728) has the molecular formula C20H25N5O4S and a molecular weight of 431.52 g/mol. Its IUPAC name is 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide
PubChem CID5298728
Molecular FormulaC20H25N5O4S
Molecular Weight431.52 g/mol
Exact Mass431.16
IUPAC Name2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide
SMILESO=C(COc1nsnc1N1CCOCC1)Nc1ccc(C(=O)N2CCCCC2)cc1
InChIInChI=1S/C20H25N5O4S/c26-17(14-29-19-18(22-30-23-19)24-10-12-28-13-11-24)21-16-6-4-15(5-7-16)20(27)25-8-2-1-3-9-25/h4-7H,1-3,8-14H2,(H,21,26)
InChIKeyKWKLCKKLHYHRMV-UHFFFAOYSA-N
XLogP2.02
TPSA96.89 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.52
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[4-(morpholine-4-carbonyl)phenoxy]-N-phenylacetamide
CID 18837739
methyl 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]acetate
CID 666373
N-[4-(morpholine-4-carbonyl)phenyl]-2-[3-(piperidine-1-carbonyl)anilino]acetamide
CID 54843375
[(Z)-[2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-1-phenylethylidene]amino]urea
CID 42426581
N-[4-(azepane-1-carbonyl)phenyl]-2-(2,5-dimethylphenoxy)acetamide
CID 17199024
N-[4-(piperidine-1-carbonyl)phenyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 100758551
methyl 2-[[4-(azepan-1-yl)-1,2,5-thiadiazol-3-yl]oxy]acetate
CID 43949441
2-[4-(morpholine-4-carbonyl)anilino]-N-[3-(piperidine-1-carbonyl)phenyl]acetamide
CID 54832001
[2-(4-morpholin-4-ylanilino)-2-oxoethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate
CID 17419831
2-(2-bromo-4-phenylphenoxy)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
CID 17194781
N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide
CID 675127
N,N'-bis[4-(piperidine-1-carbonyl)phenyl]nonanediamide
CID 43878316

Frequently Asked Questions

What is the IUPAC name of 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide?
The IUPAC name of 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide (CID 5298728) is 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide is O=C(COc1nsnc1N1CCOCC1)Nc1ccc(C(=O)N2CCCCC2)cc1.
What is the InChIKey of 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide?
The InChIKey is KWKLCKKLHYHRMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O4S/c26-17(14-29-19-18(22-30-23-19)24-10-12-28-13-11-24)21-16-6-4-15(5-7-16)20(27)25-8-2-1-3-9-25/h4-7H,1-3,8-14H2,(H,21,26).
What are the key properties of 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide?
2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide has a molecular weight of 431.52 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]-N-[4-(piperidine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 5298728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).