4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine

C14H14N2OS2 — CID 66199989

IUPAC4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine
SMILESNc1noc(CCCc2cccs2)c1-c1cccs1
InChIInChI=1S/C14H14N2OS2/c15-14-13(12-7-3-9-19-12)11(17-16-14)6-1-4-10-5-2-8-18-10/h2-3,5,7-9H,1,4,6H2,(H2,15,16)
InChIKeyZTWSKMCOQZRONP-UHFFFAOYSA-N
MW290.41 g/mol
LogP4.22
Rot. Bonds5

About 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine

4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine (PubChem CID 66199989) has the molecular formula C14H14N2OS2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine
PubChem CID66199989
Molecular FormulaC14H14N2OS2
Molecular Weight290.41 g/mol
Exact Mass290.05
IUPAC Name4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine
SMILESNc1noc(CCCc2cccs2)c1-c1cccs1
InChIInChI=1S/C14H14N2OS2/c15-14-13(12-7-3-9-19-12)11(17-16-14)6-1-4-10-5-2-8-18-10/h2-3,5,7-9H,1,4,6H2,(H2,15,16)
InChIKeyZTWSKMCOQZRONP-UHFFFAOYSA-N
XLogP4.22
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-pyridin-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine
CID 80522730
4-(2-chlorophenyl)-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine
CID 66205392
5-[2-(2-methylphenyl)ethyl]-4-thiophen-2-yl-1,2-oxazol-3-amine
CID 66199378
5-heptan-4-yl-4-thiophen-2-yl-1,2-oxazol-3-amine
CID 82987307
5-butyl-3-phenyl-4-thiophen-2-yl-1,2-oxazole
CID 135031963
2-(3-thiophen-2-ylpropyl)-1,3-thiazole
CID 141496467
3-thiophen-2-ylpropan-1-ol
CID 13109866
4-ethyl-3-(3-thiophen-2-ylpropyl)-1,2-oxazol-5-amine
CID 43670980
5-(2-fluorophenyl)-4-thiophen-2-yl-1,2-oxazol-3-amine
CID 66199577
4-pyridin-4-yl-5-thiophen-2-yl-1,2-oxazol-3-amine
CID 80525813
4-(3-chlorophenyl)-3-(3-thiophen-2-ylpropyl)-1,2-oxazol-5-amine
CID 43335624
5-(3,4-dichlorophenyl)-4-thiophen-2-yl-1,2-oxazol-3-amine
CID 66200386

Frequently Asked Questions

What is the IUPAC name of 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine?
The IUPAC name of 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine (CID 66199989) is 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine is Nc1noc(CCCc2cccs2)c1-c1cccs1.
What is the InChIKey of 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine?
The InChIKey is ZTWSKMCOQZRONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2OS2/c15-14-13(12-7-3-9-19-12)11(17-16-14)6-1-4-10-5-2-8-18-10/h2-3,5,7-9H,1,4,6H2,(H2,15,16).
What are the key properties of 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine?
4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine has a molecular weight of 290.41 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-thiophen-2-yl-5-(3-thiophen-2-ylpropyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66199989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).