N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide

C12H17NOS — CID 103741423

IUPACN-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide
SMILESCCC1(CNC(=O)c2cccs2)CCC1
InChIInChI=1S/C12H17NOS/c1-2-12(6-4-7-12)9-13-11(14)10-5-3-8-15-10/h3,5,8H,2,4,6-7,9H2,1H3,(H,13,14)
InChIKeyCLFKXZYWQDXCOW-UHFFFAOYSA-N
MW223.34 g/mol
LogP3.06
Rot. Bonds4

About N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide

N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide (PubChem CID 103741423) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide
PubChem CID103741423
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC NameN-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide
SMILESCCC1(CNC(=O)c2cccs2)CCC1
InChIInChI=1S/C12H17NOS/c1-2-12(6-4-7-12)9-13-11(14)10-5-3-8-15-10/h3,5,8H,2,4,6-7,9H2,1H3,(H,13,14)
InChIKeyCLFKXZYWQDXCOW-UHFFFAOYSA-N
XLogP3.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(1-ethylcyclobutyl)methyl]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

Related Compounds

N-[[1-(hydroxymethyl)cyclopentyl]methyl]thiophene-2-carboxamide
CID 110416723
N-[[1-(bromomethyl)cyclopentyl]methyl]thiophene-2-carboxamide
CID 115364345
N-[(1-propan-2-ylcyclopropyl)methyl]thiophene-2-carboxamide
CID 103742453
N-[(2-methylthiolan-2-yl)methyl]thiophene-2-carboxamide
CID 80528767
N-[[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl]thiophene-2-carboxamide
CID 35672039
2-amino-N-[(1-ethylcyclobutyl)methyl]benzamide
CID 103822063
N-[2-(ethylamino)ethyl]thiophene-2-carboxamide
CID 62657845
1-[[[2-(thiophene-2-carbonylamino)acetyl]amino]methyl]cyclobutane-1-carboxylic acid
CID 115445135
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]thiophene-2-carboxamide
CID 42265711
N-[(1-hydroxy-2,3-dihydroinden-1-yl)methyl]thiophene-2-carboxamide
CID 71782124
N-[(1-ethylcyclopentyl)methyl]-2-iodo-3-methylbenzamide
CID 103766399
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]thiophene-2-carboxamide
CID 42266039

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide?
The IUPAC name of N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide (CID 103741423) is N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide?
The canonical SMILES for N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide is CCC1(CNC(=O)c2cccs2)CCC1.
What is the InChIKey of N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide?
The InChIKey is CLFKXZYWQDXCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOS/c1-2-12(6-4-7-12)9-13-11(14)10-5-3-8-15-10/h3,5,8H,2,4,6-7,9H2,1H3,(H,13,14).
What are the key properties of N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide?
N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide has a molecular weight of 223.34 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclobutyl)methyl]thiophene-2-carboxamide is sourced from PubChem (CID 103741423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).