5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide

C14H16N2OS — CID 55122397

IUPAC5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC(C)c1ccsc1
InChIInChI=1S/C14H16N2OS/c1-9-3-4-12(15)7-13(9)14(17)16-10(2)11-5-6-18-8-11/h3-8,10H,15H2,1-2H3,(H,16,17)
InChIKeyKAHMKYSKEKJLOJ-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.13
Rot. Bonds3

About 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide

5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide (PubChem CID 55122397) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide
PubChem CID55122397
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC(C)c1ccsc1
InChIInChI=1S/C14H16N2OS/c1-9-3-4-12(15)7-13(9)14(17)16-10(2)11-5-6-18-8-11/h3-8,10H,15H2,1-2H3,(H,16,17)
InChIKeyKAHMKYSKEKJLOJ-UHFFFAOYSA-N
XLogP3.13
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-2-chloro-N-(1-thiophen-3-ylethyl)benzamide
CID 62840251
2-amino-3-methyl-N-(1-thiophen-3-ylethyl)benzamide
CID 62842689
2-amino-5-fluoro-N-(1-thiophen-3-ylethyl)benzamide
CID 55122299
4-amino-1-methyl-N-(1-thiophen-3-ylethyl)pyrrole-2-carboxamide
CID 62841289
3,6-dichloro-N-(1-thiophen-3-ylethyl)pyridazine-4-carboxamide
CID 114038489
2,4-dibromo-N-(1-thiophen-3-ylethyl)benzamide
CID 107952380
3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide
CID 62840601
5-amino-N-[1-(2-bromophenyl)ethyl]-2-methylbenzamide
CID 61291745
3-amino-5-methoxy-N-(1-thiophen-3-ylethyl)benzamide
CID 81091006
2-fluoro-5-sulfanyl-N-(1-thiophen-3-ylethyl)benzamide
CID 107028724
3-amino-4-chloro-N-(1-thiophen-3-ylethyl)benzamide
CID 62840598
5-amino-N-[1-(2-ethyl-1,3-thiazol-4-yl)ethyl]-2-methylbenzamide;dihydrochloride
CID 120646852

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide?
The IUPAC name of 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide (CID 55122397) is 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide.
What is the SMILES notation for 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide?
The canonical SMILES for 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide is Cc1ccc(N)cc1C(=O)NC(C)c1ccsc1.
What is the InChIKey of 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide?
The InChIKey is KAHMKYSKEKJLOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-9-3-4-12(15)7-13(9)14(17)16-10(2)11-5-6-18-8-11/h3-8,10H,15H2,1-2H3,(H,16,17).
What are the key properties of 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide?
5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide has a molecular weight of 260.36 g/mol, XLogP of 3.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide is sourced from PubChem (CID 55122397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).