N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide

C13H23N3O3S — CID 119554262

IUPACN-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide
SMILESCN(C(=O)CSCC(=O)N1CCOCC1)C1CCNC1
InChIInChI=1S/C13H23N3O3S/c1-15(11-2-3-14-8-11)12(17)9-20-10-13(18)16-4-6-19-7-5-16/h11,14H,2-10H2,1H3
InChIKeyIQGMGKAUCMAKLG-UHFFFAOYSA-N
MW301.41 g/mol
LogP-0.60
Rot. Bonds5

About N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide

N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide (PubChem CID 119554262) has the molecular formula C13H23N3O3S and a molecular weight of 301.41 g/mol. Its IUPAC name is N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound NameN-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide
PubChem CID119554262
Molecular FormulaC13H23N3O3S
Molecular Weight301.41 g/mol
Exact Mass301.15
IUPAC NameN-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide
SMILESCN(C(=O)CSCC(=O)N1CCOCC1)C1CCNC1
InChIInChI=1S/C13H23N3O3S/c1-15(11-2-3-14-8-11)12(17)9-20-10-13(18)16-4-6-19-7-5-16/h11,14H,2-10H2,1H3
InChIKeyIQGMGKAUCMAKLG-UHFFFAOYSA-N
XLogP-0.60
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide 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

2-[methyl(pyrrolidin-3-yl)amino]-1-morpholin-4-ylethanone
CID 63301630
2-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-1-morpholin-4-ylethanone
CID 119473244
4-[ethyl(pyrrolidin-3-yl)amino]-1-morpholin-4-ylbutan-1-one
CID 63299400
N-cyclopropyl-N-(1-cyclopropylethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 60559160
N-methyl-N-pyrrolidin-3-ylpropanamide
CID 60807525
N-methyl-2-methylsulfanyl-N-piperidin-3-ylacetamide
CID 63642298
N-methyl-2-morpholin-4-yl-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 124613864
N-methyl-3-methylsulfanyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119553749
N-methyl-2-(oxolan-3-yl)-N-pyrrolidin-3-ylacetamide
CID 119551379
1-morpholin-4-yl-2-[piperidin-4-yl(2,2,2-trifluoroethyl)amino]ethanone
CID 64850618
2-[methyl(pyrrolidin-3-yl)amino]-1-piperidin-1-ylethanone
CID 63301733
2-[2-(2,3-dimethylpiperazin-1-yl)-2-oxoethyl]sulfanyl-1-morpholin-4-ylethanone
CID 120572720

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide?
The IUPAC name of N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide (CID 119554262) is N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide.
What is the SMILES notation for N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide?
The canonical SMILES for N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide is CN(C(=O)CSCC(=O)N1CCOCC1)C1CCNC1.
What is the InChIKey of N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide?
The InChIKey is IQGMGKAUCMAKLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3S/c1-15(11-2-3-14-8-11)12(17)9-20-10-13(18)16-4-6-19-7-5-16/h11,14H,2-10H2,1H3.
What are the key properties of N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide?
N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide has a molecular weight of 301.41 g/mol, XLogP of -0.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 119554262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).