5-chloro-N-cyclopentyl-1,3-thiazol-2-amine

C8H11ClN2S — CID 117260277

IUPAC5-chloro-N-cyclopentyl-1,3-thiazol-2-amine
SMILESClc1cnc(NC2CCCC2)s1
InChIInChI=1S/C8H11ClN2S/c9-7-5-10-8(12-7)11-6-3-1-2-4-6/h5-6H,1-4H2,(H,10,11)
InChIKeyXMDKXUXYADQMHE-UHFFFAOYSA-N
MW202.71 g/mol
LogP3.15
Rot. Bonds2

About 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine

5-chloro-N-cyclopentyl-1,3-thiazol-2-amine (PubChem CID 117260277) has the molecular formula C8H11ClN2S and a molecular weight of 202.71 g/mol. Its IUPAC name is 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-chloro-N-cyclopentyl-1,3-thiazol-2-amine
PubChem CID117260277
Molecular FormulaC8H11ClN2S
Molecular Weight202.71 g/mol
Exact Mass202.03
IUPAC Name5-chloro-N-cyclopentyl-1,3-thiazol-2-amine
SMILESClc1cnc(NC2CCCC2)s1
InChIInChI=1S/C8H11ClN2S/c9-7-5-10-8(12-7)11-6-3-1-2-4-6/h5-6H,1-4H2,(H,10,11)
InChIKeyXMDKXUXYADQMHE-UHFFFAOYSA-N
XLogP3.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.71
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine?
The IUPAC name of 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine (CID 117260277) is 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine is Clc1cnc(NC2CCCC2)s1.
What is the InChIKey of 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine?
The InChIKey is XMDKXUXYADQMHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2S/c9-7-5-10-8(12-7)11-6-3-1-2-4-6/h5-6H,1-4H2,(H,10,11).
What are the key properties of 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine?
5-chloro-N-cyclopentyl-1,3-thiazol-2-amine has a molecular weight of 202.71 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopentyl-1,3-thiazol-2-amine is sourced from PubChem (CID 117260277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).