N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide

C13H14N2OS — CID 43152262

IUPACN-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide
SMILESCc1cccc(N)c1NC(=O)Cc1ccsc1
InChIInChI=1S/C13H14N2OS/c1-9-3-2-4-11(14)13(9)15-12(16)7-10-5-6-17-8-10/h2-6,8H,7,14H2,1H3,(H,15,16)
InChIKeyYMRBRCRIUFLSRQ-UHFFFAOYSA-N
MW246.34 g/mol
LogP2.82
Rot. Bonds3

About N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide

N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide (PubChem CID 43152262) has the molecular formula C13H14N2OS and a molecular weight of 246.34 g/mol. Its IUPAC name is N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide
PubChem CID43152262
Molecular FormulaC13H14N2OS
Molecular Weight246.34 g/mol
Exact Mass246.08
IUPAC NameN-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide
SMILESCc1cccc(N)c1NC(=O)Cc1ccsc1
InChIInChI=1S/C13H14N2OS/c1-9-3-2-4-11(14)13(9)15-12(16)7-10-5-6-17-8-10/h2-6,8H,7,14H2,1H3,(H,15,16)
InChIKeyYMRBRCRIUFLSRQ-UHFFFAOYSA-N
XLogP2.82
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-ethyl-6-methylphenyl)-2-thiophen-3-ylacetamide
CID 2603904
N-(2-amino-6-fluorophenyl)-2-thiophen-3-ylacetamide
CID 81314024
N-(2-amino-6-methylphenyl)-2-(2-methylphenyl)acetamide
CID 43152283
N-(2,6-dimethylphenyl)-2-[[(2S)-1-thiophen-3-ylpropan-2-yl]amino]acetamide
CID 97229162
N-(2-amino-6-methylphenyl)-2-methoxyacetamide
CID 43376359
N-(2,6-dimethylphenyl)-2-[4-(2-thiophen-3-ylacetyl)piperazin-1-ium-1-yl]acetamide
CID 9021448
N-(2-amino-6-methylphenyl)-4-methylthiophene-3-carboxamide
CID 79802397
N-(2-amino-6-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 43376385
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-3-thiophen-3-ylpropanamide
CID 30492683
[2-(2,6-diethylanilino)-2-oxoethyl] 2-thiophen-3-ylacetate
CID 2338102
N-(2-amino-6-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]acetamide
CID 62772095
3-bromo-2-[(2-thiophen-3-ylacetyl)amino]benzoic acid
CID 55176730

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide?
The IUPAC name of N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide (CID 43152262) is N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide?
The canonical SMILES for N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide is Cc1cccc(N)c1NC(=O)Cc1ccsc1.
What is the InChIKey of N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide?
The InChIKey is YMRBRCRIUFLSRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2OS/c1-9-3-2-4-11(14)13(9)15-12(16)7-10-5-6-17-8-10/h2-6,8H,7,14H2,1H3,(H,15,16).
What are the key properties of N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide?
N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide has a molecular weight of 246.34 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-6-methylphenyl)-2-thiophen-3-ylacetamide is sourced from PubChem (CID 43152262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).