4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide

C17H15NO2S2 — CID 121021382

IUPAC4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NC(c2ccsc2)c2cccs2)cc1
InChIInChI=1S/C17H15NO2S2/c1-20-14-6-4-12(5-7-14)17(19)18-16(13-8-10-21-11-13)15-3-2-9-22-15/h2-11,16H,1H3,(H,18,19)
InChIKeyUGNLGWWTWGXAQP-UHFFFAOYSA-N
MW329.45 g/mol
LogP4.34
Rot. Bonds5

About 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide

4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide (PubChem CID 121021382) has the molecular formula C17H15NO2S2 and a molecular weight of 329.45 g/mol. Its IUPAC name is 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide
PubChem CID121021382
Molecular FormulaC17H15NO2S2
Molecular Weight329.45 g/mol
Exact Mass329.05
IUPAC Name4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NC(c2ccsc2)c2cccs2)cc1
InChIInChI=1S/C17H15NO2S2/c1-20-14-6-4-12(5-7-14)17(19)18-16(13-8-10-21-11-13)15-3-2-9-22-15/h2-11,16H,1H3,(H,18,19)
InChIKeyUGNLGWWTWGXAQP-UHFFFAOYSA-N
XLogP4.34
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide
CID 119104238
2,3,4-trimethoxy-N-[(S)-thiophen-2-yl(thiophen-3-yl)methyl]benzamide
CID 129354524
5-chloro-2-methoxy-N-[(S)-thiophen-2-yl(thiophen-3-yl)methyl]benzamide
CID 129354714
5-bromo-N-[thiophen-2-yl(thiophen-3-yl)methyl]pyridine-3-carboxamide
CID 121021406
3-methoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]benzamide
CID 8820699
3,5-dimethoxy-N-[(4-methylphenyl)-thiophen-2-ylmethyl]benzamide
CID 17488923
N-[thiophen-2-yl(thiophen-3-yl)methyl]-1-benzofuran-2-carboxamide
CID 121021387
2-(4-chlorophenoxy)-2-methyl-N-[(S)-thiophen-2-yl(thiophen-3-yl)methyl]propanamide
CID 129354820
2-(4-chlorophenoxy)-2-methyl-N-[thiophen-2-yl(thiophen-3-yl)methyl]propanamide
CID 119104228
1-propyl-3-[(S)-thiophen-2-yl(thiophen-3-yl)methyl]urea
CID 129355017
4-(difluoromethoxy)-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]benzamide
CID 43021916
2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide
CID 78791455

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide?
The IUPAC name of 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide (CID 121021382) is 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide?
The canonical SMILES for 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide is COc1ccc(C(=O)NC(c2ccsc2)c2cccs2)cc1.
What is the InChIKey of 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide?
The InChIKey is UGNLGWWTWGXAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2S2/c1-20-14-6-4-12(5-7-14)17(19)18-16(13-8-10-21-11-13)15-3-2-9-22-15/h2-11,16H,1H3,(H,18,19).
What are the key properties of 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide?
4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide has a molecular weight of 329.45 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[thiophen-2-yl(thiophen-3-yl)methyl]benzamide is sourced from PubChem (CID 121021382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).