3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide

C14H16N2OS — CID 61094457

IUPAC3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide
SMILESCc1ccccc1CN(C)C(=O)c1sccc1N
InChIInChI=1S/C14H16N2OS/c1-10-5-3-4-6-11(10)9-16(2)14(17)13-12(15)7-8-18-13/h3-8H,9,15H2,1-2H3
InChIKeyIRUSFNGWVORESM-UHFFFAOYSA-N
MW260.36 g/mol
LogP2.91
Rot. Bonds3

About 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide

3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide (PubChem CID 61094457) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide
PubChem CID61094457
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide
SMILESCc1ccccc1CN(C)C(=O)c1sccc1N
InChIInChI=1S/C14H16N2OS/c1-10-5-3-4-6-11(10)9-16(2)14(17)13-12(15)7-8-18-13/h3-8H,9,15H2,1-2H3
InChIKeyIRUSFNGWVORESM-UHFFFAOYSA-N
XLogP2.91
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide 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-N,5-dimethyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide
CID 61094456
2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide
CID 62073809
2-amino-3-fluoro-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 62661751
N-methyl-N-[(2-methylphenyl)methyl]thiophene-3-carboxamide
CID 78803856
3-amino-N-methyl-N-propylthiophene-2-carboxamide
CID 61095360
N-[(2-aminophenyl)methyl]-N,2,6-trimethylbenzamide
CID 107999875
N-[(2-aminophenyl)methyl]-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 43383805
3-amino-N-[(3-methoxyphenyl)methyl]-N-methylthiophene-2-carboxamide
CID 54980615
4-amino-N-methyl-N-[(2-methylphenyl)methyl]-1H-pyrazole-5-carboxamide
CID 55178020
3-amino-4-bromo-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 61094065
3-amino-2,6-difluoro-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 79759533
2-(aminomethyl)-N-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 119681703

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide (CID 61094457) is 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide is Cc1ccccc1CN(C)C(=O)c1sccc1N.
What is the InChIKey of 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide?
The InChIKey is IRUSFNGWVORESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-10-5-3-4-6-11(10)9-16(2)14(17)13-12(15)7-8-18-13/h3-8H,9,15H2,1-2H3.
What are the key properties of 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide?
3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide has a molecular weight of 260.36 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide is sourced from PubChem (CID 61094457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).