2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide

C15H16N2OS — CID 55138412

IUPAC2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide
SMILESNc1ccccc1C(=O)N(Cc1ccsc1)C1CC1
InChIInChI=1S/C15H16N2OS/c16-14-4-2-1-3-13(14)15(18)17(12-5-6-12)9-11-7-8-19-10-11/h1-4,7-8,10,12H,5-6,9,16H2
InChIKeyGOMVMUYNOMUZTC-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.14
Rot. Bonds4

About 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide

2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide (PubChem CID 55138412) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide
PubChem CID55138412
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide
SMILESNc1ccccc1C(=O)N(Cc1ccsc1)C1CC1
InChIInChI=1S/C15H16N2OS/c16-14-4-2-1-3-13(14)15(18)17(12-5-6-12)9-11-7-8-19-10-11/h1-4,7-8,10,12H,5-6,9,16H2
InChIKeyGOMVMUYNOMUZTC-UHFFFAOYSA-N
XLogP3.14
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)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

2-amino-N-cyclopropyl-5-methyl-N-(thiophen-3-ylmethyl)benzamide
CID 62508692
3-(2-aminophenyl)-N-cyclopropyl-N-(thiophen-3-ylmethyl)propanamide
CID 107272972
4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 81240954
N-[(2-aminophenyl)methyl]-N-cyclopropyl-2-thiophen-3-ylacetamide
CID 43460875
N-cyclopropyl-2,5-dimethyl-N-(thiophen-3-ylmethyl)benzamide
CID 51055390
(2R)-2-amino-N-cyclopropyl-2-phenyl-N-(thiophen-3-ylmethyl)acetamide
CID 61168373
6-bromo-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
CID 113346712
N-cyclopropyl-N-(thiophen-3-ylmethyl)carbamoyl chloride
CID 79887165
N-cyclopropyl-4-hydrazinyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 81255572
2-chloro-N-cyclopropyl-2-phenyl-N-(thiophen-3-ylmethyl)acetamide
CID 61167971
2-bromo-N-cyclopropyl-6-fluoro-N-(thiophen-3-ylmethyl)benzamide
CID 114559566
N-cyclopropyl-3-iodo-N-(thiophen-3-ylmethyl)benzamide
CID 61400460

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide?
The IUPAC name of 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide (CID 55138412) is 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide.
What is the SMILES notation for 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide?
The canonical SMILES for 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide is Nc1ccccc1C(=O)N(Cc1ccsc1)C1CC1.
What is the InChIKey of 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide?
The InChIKey is GOMVMUYNOMUZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c16-14-4-2-1-3-13(14)15(18)17(12-5-6-12)9-11-7-8-19-10-11/h1-4,7-8,10,12H,5-6,9,16H2.
What are the key properties of 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide?
2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide has a molecular weight of 272.37 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide is sourced from PubChem (CID 55138412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).