N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide

C11H12N2OS2 — CID 66385011

IUPACN-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide
SMILESCC(=O)Nc1ccsc1CNc1ccsc1
InChIInChI=1S/C11H12N2OS2/c1-8(14)13-10-3-5-16-11(10)6-12-9-2-4-15-7-9/h2-5,7,12H,6H2,1H3,(H,13,14)
InChIKeyJWSIQEPKPQADMN-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.38
Rot. Bonds4

About N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide

N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide (PubChem CID 66385011) has the molecular formula C11H12N2OS2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide.

Molecular Properties

Compound NameN-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide
PubChem CID66385011
Molecular FormulaC11H12N2OS2
Molecular Weight252.36 g/mol
Exact Mass252.04
IUPAC NameN-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide
SMILESCC(=O)Nc1ccsc1CNc1ccsc1
InChIInChI=1S/C11H12N2OS2/c1-8(14)13-10-3-5-16-11(10)6-12-9-2-4-15-7-9/h2-5,7,12H,6H2,1H3,(H,13,14)
InChIKeyJWSIQEPKPQADMN-UHFFFAOYSA-N
XLogP3.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide 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-[(3-acetamidothiophen-2-yl)methylamino]benzoic acid
CID 66387123
N-[2-[(3-propan-2-ylanilino)methyl]thiophen-3-yl]acetamide
CID 66386116
N-[2-[(4-butylanilino)methyl]thiophen-3-yl]acetamide
CID 66387714
N-[2-[(3-fluoro-4-hydroxyanilino)methyl]thiophen-3-yl]acetamide
CID 66385208
3-[(3-acetamidothiophen-2-yl)methylamino]-N-methylbenzamide
CID 66385911
N-[2-[(2,3-dihydro-1H-inden-5-ylamino)methyl]thiophen-3-yl]acetamide
CID 66387299
N-[2-methyl-5-[(3-methylthiophen-2-yl)methylamino]phenyl]acetamide
CID 43735899
N-[2-[[(3-hydroxy-2,3-dimethylbutan-2-yl)amino]methyl]thiophen-3-yl]acetamide
CID 106186084
N-[2-[(2,4,6-tribromoanilino)methyl]thiophen-3-yl]acetamide
CID 66386124
N-[2-[(2-chloro-6-methylanilino)methyl]thiophen-3-yl]acetamide
CID 66384810
N-[2-[(2-hydroxyethylamino)methyl]thiophen-3-yl]acetamide
CID 66386722
N-[2-[(4-chloro-2-methoxy-5-methylanilino)methyl]thiophen-3-yl]acetamide
CID 66387889

Frequently Asked Questions

What is the IUPAC name of N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide?
The IUPAC name of N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide (CID 66385011) is N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide.
What is the SMILES notation for N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide?
The canonical SMILES for N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide is CC(=O)Nc1ccsc1CNc1ccsc1.
What is the InChIKey of N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide?
The InChIKey is JWSIQEPKPQADMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS2/c1-8(14)13-10-3-5-16-11(10)6-12-9-2-4-15-7-9/h2-5,7,12H,6H2,1H3,(H,13,14).
What are the key properties of N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide?
N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide has a molecular weight of 252.36 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(thiophen-3-ylamino)methyl]thiophen-3-yl]acetamide is sourced from PubChem (CID 66385011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).