3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide

C11H12N2OS2 — CID 62840601

IUPAC3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide
SMILESCC(NC(=O)c1sccc1N)c1ccsc1
InChIInChI=1S/C11H12N2OS2/c1-7(8-2-4-15-6-8)13-11(14)10-9(12)3-5-16-10/h2-7H,12H2,1H3,(H,13,14)
InChIKeyYWEBLWMZKCWIRK-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.88
Rot. Bonds3

About 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide

3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide (PubChem CID 62840601) has the molecular formula C11H12N2OS2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide
PubChem CID62840601
Molecular FormulaC11H12N2OS2
Molecular Weight252.36 g/mol
Exact Mass252.04
IUPAC Name3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide
SMILESCC(NC(=O)c1sccc1N)c1ccsc1
InChIInChI=1S/C11H12N2OS2/c1-7(8-2-4-15-6-8)13-11(14)10-9(12)3-5-16-10/h2-7H,12H2,1H3,(H,13,14)
InChIKeyYWEBLWMZKCWIRK-UHFFFAOYSA-N
XLogP2.88
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide
CID 54952813
3-(3-hydroxyprop-1-ynyl)-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide
CID 63796815
3-amino-N-(1-thiophen-3-ylethyl)pyridine-2-carboxamide
CID 104742232
4-amino-1-methyl-N-(1-thiophen-3-ylethyl)pyrrole-2-carboxamide
CID 62841289
2-amino-5-fluoro-N-(1-thiophen-3-ylethyl)benzamide
CID 55122299
3-amino-4-chloro-N-(1-thiophen-3-ylethyl)benzamide
CID 62840598
6-amino-N-(1-thiophen-3-ylethyl)pyridazine-3-carboxamide
CID 62844280
3-amino-N-(4-hydroxybutan-2-yl)thiophene-2-carboxamide
CID 83176272
5-bromo-N-(1-thiophen-3-ylethyl)thiophene-3-carboxamide
CID 55209412
6-amino-N-(1-thiophen-3-ylethyl)pyridine-2-carboxamide
CID 62844800
5-amino-2-methyl-N-(1-thiophen-3-ylethyl)benzamide
CID 55122397
2-amino-3-methyl-N-(1-thiophen-3-ylethyl)benzamide
CID 62842689

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide (CID 62840601) is 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide is CC(NC(=O)c1sccc1N)c1ccsc1.
What is the InChIKey of 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide?
The InChIKey is YWEBLWMZKCWIRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS2/c1-7(8-2-4-15-6-8)13-11(14)10-9(12)3-5-16-10/h2-7H,12H2,1H3,(H,13,14).
What are the key properties of 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide?
3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide is sourced from PubChem (CID 62840601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).