5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide

C15H18N2O2S — CID 79475810

IUPAC5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
SMILESCOc1ccc(N)cc1C(=O)N(C)CCc1cccs1
InChIInChI=1S/C15H18N2O2S/c1-17(8-7-12-4-3-9-20-12)15(18)13-10-11(16)5-6-14(13)19-2/h3-6,9-10H,7-8,16H2,1-2H3
InChIKeyJEUABFVRFQVKGT-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.65
Rot. Bonds5

About 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide

5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide (PubChem CID 79475810) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
PubChem CID79475810
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
SMILESCOc1ccc(N)cc1C(=O)N(C)CCc1cccs1
InChIInChI=1S/C15H18N2O2S/c1-17(8-7-12-4-3-9-20-12)15(18)13-10-11(16)5-6-14(13)19-2/h3-6,9-10H,7-8,16H2,1-2H3
InChIKeyJEUABFVRFQVKGT-UHFFFAOYSA-N
XLogP2.65
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 61093193
2-amino-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79019362
5-amino-N-ethyl-2-methoxy-N-methylbenzamide
CID 61094369
5-amino-2-methoxy-N-methyl-N-pentylbenzamide
CID 61093600
5-amino-2-[methyl(2-thiophen-2-ylethyl)amino]benzoic acid
CID 63773831
3,6-dichloro-N-methyl-N-(2-thiophen-2-ylethyl)pyridazine-4-carboxamide
CID 114038532
5-amino-N-methyl-N-(2-thiophen-2-ylethyl)-1H-pyrazole-4-carboxamide
CID 79487631
5-amino-2-methoxy-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]benzamide
CID 63843759
N-methyl-2-sulfanyl-N-(2-thiophen-2-ylethyl)benzamide
CID 107032184
2-fluoro-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79036837
4-amino-2-chloro-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527196
4-amino-3,5-dichloro-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 82833096

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide (CID 79475810) is 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide is COc1ccc(N)cc1C(=O)N(C)CCc1cccs1.
What is the InChIKey of 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide?
The InChIKey is JEUABFVRFQVKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-17(8-7-12-4-3-9-20-12)15(18)13-10-11(16)5-6-14(13)19-2/h3-6,9-10H,7-8,16H2,1-2H3.
What are the key properties of 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide?
5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide has a molecular weight of 290.39 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methoxy-N-methyl-N-(2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 79475810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).