3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide

C20H26N2O5S — CID 9094127

IUPAC3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
SMILESCOc1cc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)cc(OC)c1OC
InChIInChI=1S/C20H26N2O5S/c1-24-16-11-14(12-17(25-2)19(16)26-3)20(23)21-13-15(18-5-4-10-28-18)22-6-8-27-9-7-22/h4-5,10-12,15H,6-9,13H2,1-3H3,(H,21,23)/t15-/m1/s1
InChIKeyGGXGZGVXHGCRFX-OAHLLOKOSA-N
MW406.50 g/mol
LogP2.58
Rot. Bonds8

About 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide

3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide (PubChem CID 9094127) has the molecular formula C20H26N2O5S and a molecular weight of 406.50 g/mol. Its IUPAC name is 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide.

Molecular Properties

Compound Name3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
PubChem CID9094127
Molecular FormulaC20H26N2O5S
Molecular Weight406.50 g/mol
Exact Mass406.16
IUPAC Name3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
SMILESCOc1cc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)cc(OC)c1OC
InChIInChI=1S/C20H26N2O5S/c1-24-16-11-14(12-17(25-2)19(16)26-3)20(23)21-13-15(18-5-4-10-28-18)22-6-8-27-9-7-22/h4-5,10-12,15H,6-9,13H2,1-3H3,(H,21,23)/t15-/m1/s1
InChIKeyGGXGZGVXHGCRFX-OAHLLOKOSA-N
XLogP2.58
TPSA69.26 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.50
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3,4,5-trimethoxy-N-(2-piperidin-1-yl-2-thiophen-2-ylethyl)benzamide
CID 17014085
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 43005262
2,6-dimethoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 16831434
3-fluoro-4-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 18150850
3-methoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-4-propoxybenzamide
CID 97098857
4-methoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 30335533
3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
CID 52984959
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3,4,5-trimethoxybenzamide
CID 35041728
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 47007223
N-[(2R)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 8799388
6-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide
CID 30386631
N-[2-(3,5-dimethylpyrazol-1-yl)-2-thiophen-2-ylethyl]-3,4,5-trimethoxybenzamide
CID 122264715

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
The IUPAC name of 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide (CID 9094127) is 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide.
What is the SMILES notation for 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
The canonical SMILES for 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide is COc1cc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)cc(OC)c1OC.
What is the InChIKey of 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
The InChIKey is GGXGZGVXHGCRFX-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H26N2O5S/c1-24-16-11-14(12-17(25-2)19(16)26-3)20(23)21-13-15(18-5-4-10-28-18)22-6-8-27-9-7-22/h4-5,10-12,15H,6-9,13H2,1-3H3,(H,21,23)/t15-/m1/s1.
What are the key properties of 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide?
3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide has a molecular weight of 406.50 g/mol, XLogP of 2.58, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethoxy-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide is sourced from PubChem (CID 9094127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).