3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide

C17H29N3O3S — CID 42748474

IUPAC3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide
SMILESCCCC1SCC(C(=O)NCCN2CCOCC2)N1C(=O)C1CC1
InChIInChI=1S/C17H29N3O3S/c1-2-3-15-20(17(22)13-4-5-13)14(12-24-15)16(21)18-6-7-19-8-10-23-11-9-19/h13-15H,2-12H2,1H3,(H,18,21)
InChIKeyBCTSHTWMLIDUJL-UHFFFAOYSA-N
MW355.50 g/mol
LogP0.92
Rot. Bonds7

About 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide

3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide (PubChem CID 42748474) has the molecular formula C17H29N3O3S and a molecular weight of 355.50 g/mol. Its IUPAC name is 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide
PubChem CID42748474
Molecular FormulaC17H29N3O3S
Molecular Weight355.50 g/mol
Exact Mass355.19
IUPAC Name3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide
SMILESCCCC1SCC(C(=O)NCCN2CCOCC2)N1C(=O)C1CC1
InChIInChI=1S/C17H29N3O3S/c1-2-3-15-20(17(22)13-4-5-13)14(12-24-15)16(21)18-6-7-19-8-10-23-11-9-19/h13-15H,2-12H2,1H3,(H,18,21)
InChIKeyBCTSHTWMLIDUJL-UHFFFAOYSA-N
XLogP0.92
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.50
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide 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

3-(2-methylpropanoyl)-2-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42748097
4-(2-ethylpiperidine-1-carbonyl)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
CID 109147196
2-methyl-3-(2-morpholin-4-ylethylcarbamoyl)-1,3-thiazolidine-4-carboxylic acid
CID 63779442
N-[2-[[N'-methyl-N-(2-morpholin-4-ylethyl)carbamimidoyl]amino]ethyl]cyclopropanecarboxamide
CID 111030584
4-(4-formylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
CID 109147174
1-(2-morpholin-4-ylethyl)-3-propylurea
CID 4583080
1-methyl-N-(2-morpholin-4-ylethyl)piperidine-3-carboxamide
CID 110849698
2-(2-chlorophenyl)-3-(2-methylbenzoyl)-N-(2-morpholin-4-ylethyl)-1,3-thiazolidine-4-carboxamide
CID 42744832
4-N-cycloheptyl-1-N-(2-morpholin-4-ylethyl)cyclohexane-1,4-dicarboxamide
CID 109147192
methyl 4-(2-morpholin-4-ylethylcarbamoyl)piperidine-1-carboxylate
CID 110754087
1-butylsulfonyl-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
CID 113003547
1-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-2-carboxamide
CID 110373868

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide (CID 42748474) is 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide is CCCC1SCC(C(=O)NCCN2CCOCC2)N1C(=O)C1CC1.
What is the InChIKey of 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide?
The InChIKey is BCTSHTWMLIDUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O3S/c1-2-3-15-20(17(22)13-4-5-13)14(12-24-15)16(21)18-6-7-19-8-10-23-11-9-19/h13-15H,2-12H2,1H3,(H,18,21).
What are the key properties of 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide?
3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide has a molecular weight of 355.50 g/mol, XLogP of 0.92, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropanecarbonyl)-N-(2-morpholin-4-ylethyl)-2-propyl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 42748474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).