2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide

C16H24N2O4S — CID 122132664

IUPAC2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide
SMILESCN(C)C(=O)COCC1CN(C(=O)c2ccsc2)CC(C)(C)O1
InChIInChI=1S/C16H24N2O4S/c1-16(2)11-18(15(20)12-5-6-23-10-12)7-13(22-16)8-21-9-14(19)17(3)4/h5-6,10,13H,7-9,11H2,1-4H3
InChIKeyNPYDAZTZKBWDFT-UHFFFAOYSA-N
MW340.45 g/mol
LogP1.47
Rot. Bonds5

About 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide

2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide (PubChem CID 122132664) has the molecular formula C16H24N2O4S and a molecular weight of 340.45 g/mol. Its IUPAC name is 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide
PubChem CID122132664
Molecular FormulaC16H24N2O4S
Molecular Weight340.45 g/mol
Exact Mass340.15
IUPAC Name2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide
SMILESCN(C)C(=O)COCC1CN(C(=O)c2ccsc2)CC(C)(C)O1
InChIInChI=1S/C16H24N2O4S/c1-16(2)11-18(15(20)12-5-6-23-10-12)7-13(22-16)8-21-9-14(19)17(3)4/h5-6,10,13H,7-9,11H2,1-4H3
InChIKeyNPYDAZTZKBWDFT-UHFFFAOYSA-N
XLogP1.47
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide?
The IUPAC name of 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide (CID 122132664) is 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide?
The canonical SMILES for 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide is CN(C)C(=O)COCC1CN(C(=O)c2ccsc2)CC(C)(C)O1.
What is the InChIKey of 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide?
The InChIKey is NPYDAZTZKBWDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4S/c1-16(2)11-18(15(20)12-5-6-23-10-12)7-13(22-16)8-21-9-14(19)17(3)4/h5-6,10,13H,7-9,11H2,1-4H3.
What are the key properties of 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide?
2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide has a molecular weight of 340.45 g/mol, XLogP of 1.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6,6-dimethyl-4-(thiophene-3-carbonyl)morpholin-2-yl]methoxy]-N,N-dimethylacetamide is sourced from PubChem (CID 122132664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).