4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide

C11H13F3N2OS — CID 55006977

IUPAC4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
SMILESCc1sc(C(=O)N(CC(F)(F)F)C2CC2)cc1N
InChIInChI=1S/C11H13F3N2OS/c1-6-8(15)4-9(18-6)10(17)16(7-2-3-7)5-11(12,13)14/h4,7H,2-3,5,15H2,1H3
InChIKeyHDFMWZUZDNOWIR-UHFFFAOYSA-N
MW278.30 g/mol
LogP2.81
Rot. Bonds3

About 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide

4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide (PubChem CID 55006977) has the molecular formula C11H13F3N2OS and a molecular weight of 278.30 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
PubChem CID55006977
Molecular FormulaC11H13F3N2OS
Molecular Weight278.30 g/mol
Exact Mass278.07
IUPAC Name4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
SMILESCc1sc(C(=O)N(CC(F)(F)F)C2CC2)cc1N
InChIInChI=1S/C11H13F3N2OS/c1-6-8(15)4-9(18-6)10(17)16(7-2-3-7)5-11(12,13)14/h4,7H,2-3,5,15H2,1H3
InChIKeyHDFMWZUZDNOWIR-UHFFFAOYSA-N
XLogP2.81
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)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

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
The IUPAC name of 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide (CID 55006977) is 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
The canonical SMILES for 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide is Cc1sc(C(=O)N(CC(F)(F)F)C2CC2)cc1N.
What is the InChIKey of 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
The InChIKey is HDFMWZUZDNOWIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2OS/c1-6-8(15)4-9(18-6)10(17)16(7-2-3-7)5-11(12,13)14/h4,7H,2-3,5,15H2,1H3.
What are the key properties of 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?
4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide has a molecular weight of 278.30 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-5-methyl-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide is sourced from PubChem (CID 55006977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).