5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine

C12H14N2S2 — CID 125431591

IUPAC5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine
SMILESNc1ncc(C2(c3cccs3)CCCC2)s1
InChIInChI=1S/C12H14N2S2/c13-11-14-8-10(16-11)12(5-1-2-6-12)9-4-3-7-15-9/h3-4,7-8H,1-2,5-6H2,(H2,13,14)
InChIKeyJLISVSCUUHNXBC-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.65
Rot. Bonds2

About 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine

5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine (PubChem CID 125431591) has the molecular formula C12H14N2S2 and a molecular weight of 250.39 g/mol. Its IUPAC name is 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine
PubChem CID125431591
Molecular FormulaC12H14N2S2
Molecular Weight250.39 g/mol
Exact Mass250.06
IUPAC Name5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine
SMILESNc1ncc(C2(c3cccs3)CCCC2)s1
InChIInChI=1S/C12H14N2S2/c13-11-14-8-10(16-11)12(5-1-2-6-12)9-4-3-7-15-9/h3-4,7-8H,1-2,5-6H2,(H2,13,14)
InChIKeyJLISVSCUUHNXBC-UHFFFAOYSA-N
XLogP3.65
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine (CID 125431591) is 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine is Nc1ncc(C2(c3cccs3)CCCC2)s1.
What is the InChIKey of 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine?
The InChIKey is JLISVSCUUHNXBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S2/c13-11-14-8-10(16-11)12(5-1-2-6-12)9-4-3-7-15-9/h3-4,7-8H,1-2,5-6H2,(H2,13,14).
What are the key properties of 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine?
5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine has a molecular weight of 250.39 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-thiophen-2-ylcyclopentyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 125431591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).