N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide

C16H23N3O4S — CID 109001792

IUPACN-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide
SMILESO=C(CNc1ccccc1N1CCOCC1)NC1CCS(=O)(=O)C1
InChIInChI=1S/C16H23N3O4S/c20-16(18-13-5-10-24(21,22)12-13)11-17-14-3-1-2-4-15(14)19-6-8-23-9-7-19/h1-4,13,17H,5-12H2,(H,18,20)
InChIKeyLUQSMUUDNSSUPK-UHFFFAOYSA-N
MW353.44 g/mol
LogP0.24
Rot. Bonds5

About N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide

N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide (PubChem CID 109001792) has the molecular formula C16H23N3O4S and a molecular weight of 353.44 g/mol. Its IUPAC name is N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide.

Molecular Properties

Compound NameN-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide
PubChem CID109001792
Molecular FormulaC16H23N3O4S
Molecular Weight353.44 g/mol
Exact Mass353.14
IUPAC NameN-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide
SMILESO=C(CNc1ccccc1N1CCOCC1)NC1CCS(=O)(=O)C1
InChIInChI=1S/C16H23N3O4S/c20-16(18-13-5-10-24(21,22)12-13)11-17-14-3-1-2-4-15(14)19-6-8-23-9-7-19/h1-4,13,17H,5-12H2,(H,18,20)
InChIKeyLUQSMUUDNSSUPK-UHFFFAOYSA-N
XLogP0.24
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.44
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide 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

N-(1,1-dioxothiolan-3-yl)-2-[ethyl-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]amino]acetamide
CID 4968344
2-[2-(azepan-1-yl)anilino]-N-cyclopropylacetamide
CID 25349530
N-cycloheptyl-3-(2-morpholin-4-ylanilino)propanamide
CID 109031514
N-(1,1-dioxothiolan-3-yl)-2-[2-(N-methylanilino)anilino]acetamide
CID 51117326
N-(2-chlorophenyl)-2-(2-morpholin-4-ylanilino)acetamide
CID 109008426
N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylethylamino)acetamide
CID 108994771
N-(1,1-dioxothian-4-yl)-2-morpholin-4-ylbenzamide
CID 91766122
2-(2-bromoanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109010619
4-N-(1,1-dioxothiolan-3-yl)-6-N-(2-morpholin-4-ylphenyl)pyrimidine-4,6-diamine
CID 112862016
N-[(3S)-1,1-dioxothiolan-3-yl]-2-phenylacetamide
CID 40569648
2-(2-morpholin-4-ylanilino)-N-(4-piperidin-1-ylphenyl)acetamide
CID 109010529
N-[(4-fluorophenyl)methyl]-2-(2-morpholin-4-ylanilino)acetamide
CID 108997897

Frequently Asked Questions

What is the IUPAC name of N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide?
The IUPAC name of N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide (CID 109001792) is N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide.
What is the SMILES notation for N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide?
The canonical SMILES for N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide is O=C(CNc1ccccc1N1CCOCC1)NC1CCS(=O)(=O)C1.
What is the InChIKey of N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide?
The InChIKey is LUQSMUUDNSSUPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O4S/c20-16(18-13-5-10-24(21,22)12-13)11-17-14-3-1-2-4-15(14)19-6-8-23-9-7-19/h1-4,13,17H,5-12H2,(H,18,20).
What are the key properties of N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide?
N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide has a molecular weight of 353.44 g/mol, XLogP of 0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-dioxothiolan-3-yl)-2-(2-morpholin-4-ylanilino)acetamide is sourced from PubChem (CID 109001792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).