2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide

C14H16N2OS — CID 43527191

IUPAC2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
SMILESCN(Cc1cccs1)C(=O)Cc1ccccc1N
InChIInChI=1S/C14H16N2OS/c1-16(10-12-6-4-8-18-12)14(17)9-11-5-2-3-7-13(11)15/h2-8H,9-10,15H2,1H3
InChIKeyCALTXYWUMWUJHU-UHFFFAOYSA-N
MW260.36 g/mol
LogP2.53
Rot. Bonds4

About 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide

2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 43527191) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
PubChem CID43527191
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
SMILESCN(Cc1cccs1)C(=O)Cc1ccccc1N
InChIInChI=1S/C14H16N2OS/c1-16(10-12-6-4-8-18-12)14(17)9-11-5-2-3-7-13(11)15/h2-8H,9-10,15H2,1H3
InChIKeyCALTXYWUMWUJHU-UHFFFAOYSA-N
XLogP2.53
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide
CID 61115894
2-(2-amino-1,3-thiazol-4-yl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 62798161
N-methyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 110733634
2-(2-aminophenyl)-N-[(2-chlorophenyl)methyl]-N-methylacetamide
CID 61117245
2-[[methyl(2-thiophen-2-ylethyl)amino]methyl]aniline
CID 63774945
2-(2-aminophenyl)-N-methyl-N-(1-thiophen-2-ylethyl)acetamide
CID 61109028
3-hydroxy-N-methyl-N-(thiophen-2-ylmethyl)propanamide
CID 115139118
4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 43527540
2-[(2-chlorophenyl)methyl-methylamino]-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 78788041
2-(3-amino-2-methylphenyl)sulfanyl-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 79143453
3-amino-N,2-dimethyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527192
2-(2-aminophenyl)-N-[(3-chlorophenyl)methyl]-N-methylacetamide
CID 61117260

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide (CID 43527191) is 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide is CN(Cc1cccs1)C(=O)Cc1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is CALTXYWUMWUJHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-16(10-12-6-4-8-18-12)14(17)9-11-5-2-3-7-13(11)15/h2-8H,9-10,15H2,1H3.
What are the key properties of 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 260.36 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 43527191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).