4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine

C8H12ClN3S — CID 83152675

IUPAC4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine
SMILESClc1csc(NN2CCCCC2)n1
InChIInChI=1S/C8H12ClN3S/c9-7-6-13-8(10-7)11-12-4-2-1-3-5-12/h6H,1-5H2,(H,10,11)
InChIKeyCXIQNDVDJIMHBB-UHFFFAOYSA-N
MW217.72 g/mol
LogP2.61
Rot. Bonds2

About 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine

4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine (PubChem CID 83152675) has the molecular formula C8H12ClN3S and a molecular weight of 217.72 g/mol. Its IUPAC name is 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine
PubChem CID83152675
Molecular FormulaC8H12ClN3S
Molecular Weight217.72 g/mol
Exact Mass217.04
IUPAC Name4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine
SMILESClc1csc(NN2CCCCC2)n1
InChIInChI=1S/C8H12ClN3S/c9-7-6-13-8(10-7)11-12-4-2-1-3-5-12/h6H,1-5H2,(H,10,11)
InChIKeyCXIQNDVDJIMHBB-UHFFFAOYSA-N
XLogP2.61
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.72
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine
CID 83152797
4-chloro-N-(1-piperidin-1-ylpropan-2-yl)-1,3-thiazol-2-amine
CID 83152888
2-(azepan-1-yl)-4-chloro-1,3-thiazole
CID 83155585
4-chloro-N-(2-pyrrolidin-1-ylpropyl)-1,3-thiazol-2-amine
CID 83152672
N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-4-chloro-1,3-thiazol-2-amine
CID 83152062
3-chloro-6-(piperidin-1-ylamino)pyridine-2-carboxylic acid
CID 83016199
4-chloro-N-(cyclopentylmethyl)-1,3-thiazol-2-amine
CID 83152879
5-N-piperidin-1-yl-1,2,4-thiadiazole-3,5-diamine
CID 83024267
4-chloro-N-(2-methylbut-3-yn-2-yl)-1,3-thiazol-2-amine
CID 83152071
N-[1-(aminomethyl)cyclopentyl]-4-chloro-1,3-thiazol-2-amine
CID 83157009
N-(1-adamantyl)-4-chloro-1,3-thiazol-2-amine
CID 83152924
4-[(4-chloro-1,3-thiazol-2-yl)amino]cyclohexan-1-ol
CID 83152279

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine (CID 83152675) is 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine is Clc1csc(NN2CCCCC2)n1.
What is the InChIKey of 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine?
The InChIKey is CXIQNDVDJIMHBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12ClN3S/c9-7-6-13-8(10-7)11-12-4-2-1-3-5-12/h6H,1-5H2,(H,10,11).
What are the key properties of 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine?
4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine has a molecular weight of 217.72 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-piperidin-1-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 83152675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).