2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide

C14H15NO3S — CID 17173324

IUPAC2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide
SMILESCOc1cccc(C(=O)NCc2cccs2)c1OC
InChIInChI=1S/C14H15NO3S/c1-17-12-7-3-6-11(13(12)18-2)14(16)15-9-10-5-4-8-19-10/h3-8H,9H2,1-2H3,(H,15,16)
InChIKeyPOEFDNSMHORABA-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.70
Rot. Bonds5

About 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide

2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 17173324) has the molecular formula C14H15NO3S and a molecular weight of 277.35 g/mol. Its IUPAC name is 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide
PubChem CID17173324
Molecular FormulaC14H15NO3S
Molecular Weight277.35 g/mol
Exact Mass277.08
IUPAC Name2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide
SMILESCOc1cccc(C(=O)NCc2cccs2)c1OC
InChIInChI=1S/C14H15NO3S/c1-17-12-7-3-6-11(13(12)18-2)14(16)15-9-10-5-4-8-19-10/h3-8H,9H2,1-2H3,(H,15,16)
InChIKeyPOEFDNSMHORABA-UHFFFAOYSA-N
XLogP2.70
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-3-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 43242463
2,3-dimethoxy-N-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]benzamide
CID 16867606
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
4-methoxy-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 91813988
5-chloro-2-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 887260
5-amino-2-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 61093193
7-methoxy-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 121083749
N-[(4-chlorophenyl)methyl]-2,3-dimethoxybenzamide
CID 912340
2-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 3580913
N-(2-amino-2-methylpropyl)-2,3-dimethoxybenzamide;hydrochloride
CID 119630210
N-[(2-fluorophenyl)methyl]-2,3-dimethoxybenzamide
CID 17068329
N-(thiophen-2-ylmethyl)-2-[3-[2-(thiophen-2-ylmethylcarbamoyl)phenoxy]-2,2-bis[[2-(thiophen-2-ylmethylcarbamoyl)phenoxy]methyl]propoxy]benzamide
CID 102205335

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide (CID 17173324) is 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide is COc1cccc(C(=O)NCc2cccs2)c1OC.
What is the InChIKey of 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is POEFDNSMHORABA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3S/c1-17-12-7-3-6-11(13(12)18-2)14(16)15-9-10-5-4-8-19-10/h3-8H,9H2,1-2H3,(H,15,16).
What are the key properties of 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide?
2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 277.35 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 17173324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).