3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide

C19H23N3O3S — CID 18150838

IUPAC3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1
InChIInChI=1S/C19H23N3O3S/c1-14(23)21-16-5-2-4-15(12-16)19(24)20-13-17(18-6-3-11-26-18)22-7-9-25-10-8-22/h2-6,11-12,17H,7-10,13H2,1H3,(H,20,24)(H,21,23)
InChIKeyYVGLFFLPGFYGLD-UHFFFAOYSA-N
MW373.48 g/mol
LogP2.51
Rot. Bonds6

About 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide

3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (PubChem CID 18150838) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
PubChem CID18150838
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC Name3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1
InChIInChI=1S/C19H23N3O3S/c1-14(23)21-16-5-2-4-15(12-16)19(24)20-13-17(18-6-3-11-26-18)22-7-9-25-10-8-22/h2-6,11-12,17H,7-10,13H2,1H3,(H,20,24)(H,21,23)
InChIKeyYVGLFFLPGFYGLD-UHFFFAOYSA-N
XLogP2.51
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide (CID 18150838) is 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is CC(=O)Nc1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1.
What is the InChIKey of 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
The InChIKey is YVGLFFLPGFYGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-14(23)21-16-5-2-4-15(12-16)19(24)20-13-17(18-6-3-11-26-18)22-7-9-25-10-8-22/h2-6,11-12,17H,7-10,13H2,1H3,(H,20,24)(H,21,23).
What are the key properties of 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide?
3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide has a molecular weight of 373.48 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 18150838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).