2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide

C11H15N3O2S — CID 119616396

IUPAC2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide
SMILESNCC(NC(=O)c1cc(C(N)=O)cs1)C1CC1
InChIInChI=1S/C11H15N3O2S/c12-4-8(6-1-2-6)14-11(16)9-3-7(5-17-9)10(13)15/h3,5-6,8H,1-2,4,12H2,(H2,13,15)(H,14,16)
InChIKeyKPBODNWYGNSBNN-UHFFFAOYSA-N
MW253.33 g/mol
LogP0.31
Rot. Bonds5

About 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide

2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide (PubChem CID 119616396) has the molecular formula C11H15N3O2S and a molecular weight of 253.33 g/mol. Its IUPAC name is 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide
PubChem CID119616396
Molecular FormulaC11H15N3O2S
Molecular Weight253.33 g/mol
Exact Mass253.09
IUPAC Name2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide
SMILESNCC(NC(=O)c1cc(C(N)=O)cs1)C1CC1
InChIInChI=1S/C11H15N3O2S/c12-4-8(6-1-2-6)14-11(16)9-3-7(5-17-9)10(13)15/h3,5-6,8H,1-2,4,12H2,(H2,13,15)(H,14,16)
InChIKeyKPBODNWYGNSBNN-UHFFFAOYSA-N
XLogP0.31
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide 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

N-(2-amino-1-cyclopropylethyl)-4-methoxythiophene-2-carboxamide;hydrochloride
CID 119615925
2-N-[(S)-cyclopropyl-(4-fluorophenyl)methyl]thiophene-2,4-dicarboxamide
CID 95616963
2-N-[(S)-cyclopropyl-(2-methylphenyl)methyl]thiophene-2,4-dicarboxamide
CID 95979886
N-(2-amino-1-cyclopropylethyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102711574
2-N-(4-aminocyclohexyl)thiophene-2,4-dicarboxamide
CID 119477780
2-N-(1-amino-2-cyclopropylpropan-2-yl)thiophene-2,4-dicarboxamide;hydrochloride
CID 119574938
N-(2-amino-1-cyclopropylethyl)-5-chlorothiophene-2-carboxamide;hydrochloride
CID 119617339
N-(2-amino-1-cyclopropylethyl)naphthalene-2-carboxamide
CID 65189109
N-(2-amino-1-cyclopropylethyl)-1,3-benzothiazole-6-carboxamide
CID 119616230
N-(2-amino-1-cyclopropylethyl)-4-bromo-3-fluorobenzamide
CID 65188732
N-(2-amino-1-cyclopropylethyl)-1-benzothiophene-2-carboxamide;hydrochloride
CID 119613670
N-(2-amino-1-cyclopropylethyl)-5-methyl-4-nitrothiophene-2-carboxamide;hydrochloride
CID 119615656

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide?
The IUPAC name of 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide (CID 119616396) is 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide?
The canonical SMILES for 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide is NCC(NC(=O)c1cc(C(N)=O)cs1)C1CC1.
What is the InChIKey of 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide?
The InChIKey is KPBODNWYGNSBNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2S/c12-4-8(6-1-2-6)14-11(16)9-3-7(5-17-9)10(13)15/h3,5-6,8H,1-2,4,12H2,(H2,13,15)(H,14,16).
What are the key properties of 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide?
2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide has a molecular weight of 253.33 g/mol, XLogP of 0.31, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-amino-1-cyclopropylethyl)thiophene-2,4-dicarboxamide is sourced from PubChem (CID 119616396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).