3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide

C15H14N2OS3 — CID 170875791

IUPAC3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide
SMILESNC(=O)CC(N)c1ccc(-c2ccc(-c3cccs3)s2)s1
InChIInChI=1S/C15H14N2OS3/c16-9(8-15(17)18)10-3-4-13(20-10)14-6-5-12(21-14)11-2-1-7-19-11/h1-7,9H,8,16H2,(H2,17,18)
InChIKeyUGRSIYJIXRZWOF-UHFFFAOYSA-N
MW334.49 g/mol
LogP4.08
Rot. Bonds5

About 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide

3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide (PubChem CID 170875791) has the molecular formula C15H14N2OS3 and a molecular weight of 334.49 g/mol. Its IUPAC name is 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide.

Molecular Properties

Compound Name3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide
PubChem CID170875791
Molecular FormulaC15H14N2OS3
Molecular Weight334.49 g/mol
Exact Mass334.03
IUPAC Name3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide
SMILESNC(=O)CC(N)c1ccc(-c2ccc(-c3cccs3)s2)s1
InChIInChI=1S/C15H14N2OS3/c16-9(8-15(17)18)10-3-4-13(20-10)14-6-5-12(21-14)11-2-1-7-19-11/h1-7,9H,8,16H2,(H2,17,18)
InChIKeyUGRSIYJIXRZWOF-UHFFFAOYSA-N
XLogP4.08
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.49
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-thiophen-2-ylthiophen-2-yl)ethanol
CID 14954981
1-(5-thiophen-2-ylthiophen-2-yl)propan-1-ol
CID 18920444
3-amino-3-[5-(5-bromothiophen-2-yl)thiophen-2-yl]propanoic acid
CID 170872483
1-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propan-2-amine
CID 170890943
2,5-dithiophen-2-ylthiophene;ethane
CID 169103820
5-amino-3-methyl-5-thiophen-2-ylpentanamide
CID 62933995
4-amino-4-thiophen-2-ylbutanamide
CID 60860619
N-[2-hydroxy-2-(5-thiophen-2-ylthiophen-2-yl)ethyl]thiophene-2-carboxamide
CID 126852656
2,2,2-trichloro-1-(5-thiophen-2-ylthiophen-2-yl)ethanol
CID 134097787
ethyl 5-(5-thiophen-2-ylthiophen-2-yl)-1,3,4-thiadiazole-2-carboxylate
CID 66647225
5-(5-thiophen-2-ylthiophen-2-yl)thiophene-2-carbonyl chloride
CID 58729671
ethyl 5-(5-thiophen-2-ylthiophen-2-yl)thiophene-2-carboxylate
CID 58814529

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide?
The IUPAC name of 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide (CID 170875791) is 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide.
What is the SMILES notation for 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide?
The canonical SMILES for 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide is NC(=O)CC(N)c1ccc(-c2ccc(-c3cccs3)s2)s1.
What is the InChIKey of 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide?
The InChIKey is UGRSIYJIXRZWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS3/c16-9(8-15(17)18)10-3-4-13(20-10)14-6-5-12(21-14)11-2-1-7-19-11/h1-7,9H,8,16H2,(H2,17,18).
What are the key properties of 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide?
3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide has a molecular weight of 334.49 g/mol, XLogP of 4.08, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanamide is sourced from PubChem (CID 170875791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).