N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide

C11H16N2OS — CID 65238929

IUPACN-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide
SMILESCc1cc(C(=O)NC2CC(N)C2)sc1C
InChIInChI=1S/C11H16N2OS/c1-6-3-10(15-7(6)2)11(14)13-9-4-8(12)5-9/h3,8-9H,4-5,12H2,1-2H3,(H,13,14)
InChIKeyJIJQUSNNMNJYPY-UHFFFAOYSA-N
MW224.33 g/mol
LogP1.58
Rot. Bonds2

About N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide

N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide (PubChem CID 65238929) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide
PubChem CID65238929
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC NameN-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide
SMILESCc1cc(C(=O)NC2CC(N)C2)sc1C
InChIInChI=1S/C11H16N2OS/c1-6-3-10(15-7(6)2)11(14)13-9-4-8(12)5-9/h3,8-9H,4-5,12H2,1-2H3,(H,13,14)
InChIKeyJIJQUSNNMNJYPY-UHFFFAOYSA-N
XLogP1.58
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-aminocyclobutyl)-4,5-dimethylthiophene-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-[(4,5-dimethylthiophene-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 54921009
N-(3-aminocyclobutyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 43595018
4-[(1S,2R)-2-aminocyclopropyl]-5-methyl-N-(oxan-4-yl)thiophene-2-carboxamide
CID 118432628
N-(2-acetamidoethyl)-4,5-dimethylthiophene-2-carboxamide
CID 30596154
(2S,3R)-3-[(4,5-dimethylthiophene-2-carbonyl)amino]oxolane-2-carboxylic acid
CID 136583516
N-(3-aminocyclobutyl)-2,5-dichlorothiophene-3-carboxamide
CID 107963472
N-(3-aminocyclobutyl)-4-bromo-2-methylbenzamide
CID 43630056
N-[1-(1-adamantyl)propyl]-4,5-dimethylthiophene-2-carboxamide
CID 19585483
(2S)-2-[(4,5-dimethylthiophene-2-carbonyl)amino]propanoic acid
CID 61132299
N-(4-aminocyclohexyl)-5-(4-fluorophenyl)-4-methylthiophene-2-carboxamide
CID 119477809
2-[(4,5-dimethylthiophene-2-carbonyl)amino]-1-methylcyclopentane-1-carboxylic acid
CID 82759937
N-(2-amino-2-cyclopropylethyl)-4,5-dimethylthiophene-2-carboxamide
CID 115301198

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide?
The IUPAC name of N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide (CID 65238929) is N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide.
What is the SMILES notation for N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide?
The canonical SMILES for N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide is Cc1cc(C(=O)NC2CC(N)C2)sc1C.
What is the InChIKey of N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide?
The InChIKey is JIJQUSNNMNJYPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-6-3-10(15-7(6)2)11(14)13-9-4-8(12)5-9/h3,8-9H,4-5,12H2,1-2H3,(H,13,14).
What are the key properties of N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide?
N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide has a molecular weight of 224.33 g/mol, XLogP of 1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)-4,5-dimethylthiophene-2-carboxamide is sourced from PubChem (CID 65238929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).