2,4-dimethoxy-5-thiophen-2-ylbenzamide

C13H13NO3S — CID 154572767

IUPAC2,4-dimethoxy-5-thiophen-2-ylbenzamide
SMILESCOc1cc(OC)c(-c2cccs2)cc1C(N)=O
InChIInChI=1S/C13H13NO3S/c1-16-10-7-11(17-2)9(13(14)15)6-8(10)12-4-3-5-18-12/h3-7H,1-2H3,(H2,14,15)
InChIKeyKNQBHLSLQRAZFZ-UHFFFAOYSA-N
MW263.32 g/mol
LogP2.53
Rot. Bonds4

About 2,4-dimethoxy-5-thiophen-2-ylbenzamide

2,4-dimethoxy-5-thiophen-2-ylbenzamide (PubChem CID 154572767) has the molecular formula C13H13NO3S and a molecular weight of 263.32 g/mol. Its IUPAC name is 2,4-dimethoxy-5-thiophen-2-ylbenzamide.

Molecular Properties

Compound Name2,4-dimethoxy-5-thiophen-2-ylbenzamide
PubChem CID154572767
Molecular FormulaC13H13NO3S
Molecular Weight263.32 g/mol
Exact Mass263.06
IUPAC Name2,4-dimethoxy-5-thiophen-2-ylbenzamide
SMILESCOc1cc(OC)c(-c2cccs2)cc1C(N)=O
InChIInChI=1S/C13H13NO3S/c1-16-10-7-11(17-2)9(13(14)15)6-8(10)12-4-3-5-18-12/h3-7H,1-2H3,(H2,14,15)
InChIKeyKNQBHLSLQRAZFZ-UHFFFAOYSA-N
XLogP2.53
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[5-(3-Hydroxyprop-1-Yn-1-Yl)thiophen-2-Yl]-2,4-Dimethoxy-N-[(3-Methoxyphenyl)sulfonyl]benzamide
CID 121232415
4-[2-Carbamoyl-5-(thiophen-3-ylmethoxy)-phenoxy]-4-o-tolyl-butyric acid
CID 10693679
N-(benzenesulfonyl)-5-[5-(3-hydroxyprop-1-ynyl)thiophen-2-yl]-2,4-dimethoxybenzamide
CID 127043025
(E)-1-(2,6-Dimethoxy-phenyl)-3-(2-methoxy-5-thiophen-2-yl-phenyl)-propenone
CID 22025565
(E)-3-(2-Methoxy-5-thiophen-2-yl-phenyl)-1-(2,4,6-trimethoxy-phenyl)-propenone
CID 22025589
2-(2-Phenoxyethoxy)-5-thiophen-3-ylbenzamide
CID 70693495
1-(2-Hydroxy-4-methoxyphenyl)-3-thiophen-2-ylprop-2-en-1-one
CID 244092
2,4-dimethoxy-N-(2-phenylethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 9507988
(E)-1-(5-methoxy-2,2-dimethylchromen-8-yl)-3-thiophen-3-ylprop-2-en-1-one
CID 66573647
(E)-1-(5-methoxy-2,2-dimethylchromen-8-yl)-3-thiophen-2-ylprop-2-en-1-one
CID 66573718
Methyl 3-[(2,4-dimethoxybenzoyl)amino]-3-thiophen-2-ylpropanoate
CID 45804632
7-Methoxy-2-(3-methylthiophen-2-yl)chromen-4-one
CID 127032273

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-5-thiophen-2-ylbenzamide?
The IUPAC name of 2,4-dimethoxy-5-thiophen-2-ylbenzamide (CID 154572767) is 2,4-dimethoxy-5-thiophen-2-ylbenzamide.
What is the SMILES notation for 2,4-dimethoxy-5-thiophen-2-ylbenzamide?
The canonical SMILES for 2,4-dimethoxy-5-thiophen-2-ylbenzamide is COc1cc(OC)c(-c2cccs2)cc1C(N)=O.
What is the InChIKey of 2,4-dimethoxy-5-thiophen-2-ylbenzamide?
The InChIKey is KNQBHLSLQRAZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO3S/c1-16-10-7-11(17-2)9(13(14)15)6-8(10)12-4-3-5-18-12/h3-7H,1-2H3,(H2,14,15).
What are the key properties of 2,4-dimethoxy-5-thiophen-2-ylbenzamide?
2,4-dimethoxy-5-thiophen-2-ylbenzamide has a molecular weight of 263.32 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-5-thiophen-2-ylbenzamide is sourced from PubChem (CID 154572767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).