N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide

C10H13NO2S — CID 126856547

IUPACN-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide
SMILESCc1csc(C(=O)NC2CCC2O)c1
InChIInChI=1S/C10H13NO2S/c1-6-4-9(14-5-6)10(13)11-7-2-3-8(7)12/h4-5,7-8,12H,2-3H2,1H3,(H,11,13)
InChIKeyXGUSMZRHEJFMBD-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.31
Rot. Bonds2

About N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide

N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide (PubChem CID 126856547) has the molecular formula C10H13NO2S and a molecular weight of 211.29 g/mol. Its IUPAC name is N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide
PubChem CID126856547
Molecular FormulaC10H13NO2S
Molecular Weight211.29 g/mol
Exact Mass211.07
IUPAC NameN-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide
SMILESCc1csc(C(=O)NC2CCC2O)c1
InChIInChI=1S/C10H13NO2S/c1-6-4-9(14-5-6)10(13)11-7-2-3-8(7)12/h4-5,7-8,12H,2-3H2,1H3,(H,11,13)
InChIKeyXGUSMZRHEJFMBD-UHFFFAOYSA-N
XLogP1.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-hydroxycyclobutyl)-4-methylthiophene-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 N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide?
The IUPAC name of N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide (CID 126856547) is N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide is Cc1csc(C(=O)NC2CCC2O)c1.
What is the InChIKey of N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide?
The InChIKey is XGUSMZRHEJFMBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2S/c1-6-4-9(14-5-6)10(13)11-7-2-3-8(7)12/h4-5,7-8,12H,2-3H2,1H3,(H,11,13).
What are the key properties of N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide?
N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclobutyl)-4-methylthiophene-2-carboxamide is sourced from PubChem (CID 126856547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).