4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole

C10H15ClN2S — CID 83156082

IUPAC4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole
SMILESCCC1CCN(c2nc(Cl)cs2)CC1
InChIInChI=1S/C10H15ClN2S/c1-2-8-3-5-13(6-4-8)10-12-9(11)7-14-10/h7-8H,2-6H2,1H3
InChIKeyRWEWYRKPUZYHHV-UHFFFAOYSA-N
MW230.76 g/mol
LogP3.42
Rot. Bonds2

About 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole

4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole (PubChem CID 83156082) has the molecular formula C10H15ClN2S and a molecular weight of 230.76 g/mol. Its IUPAC name is 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole.

Molecular Properties

Compound Name4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole
PubChem CID83156082
Molecular FormulaC10H15ClN2S
Molecular Weight230.76 g/mol
Exact Mass230.06
IUPAC Name4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole
SMILESCCC1CCN(c2nc(Cl)cs2)CC1
InChIInChI=1S/C10H15ClN2S/c1-2-8-3-5-13(6-4-8)10-12-9(11)7-14-10/h7-8H,2-6H2,1H3
InChIKeyRWEWYRKPUZYHHV-UHFFFAOYSA-N
XLogP3.42
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.76
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Piperidinyl(trimethylstannyl)thiazole
CID 59118286
4-Chloro-2-[3-(trifluoromethyl)piperidin-1-yl]-1,3-thiazole
CID 83156608
4-Chloro-2-[4-(trifluoromethyl)piperidin-1-yl]-1,3-thiazole
CID 83156731
1-(4-Chloro-1,3-thiazol-2-yl)-4,4-difluoropiperidine
CID 164648549
1-(4-Chloro-1,3-thiazol-2-yl)-4-fluoropiperidine
CID 164651185
N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine
CID 15329642
4-(4-Propylpiperidin-1-yl)-1,3-thiazol-2-amine
CID 20143738
4-Chloro-2-(piperidin-1-YL)thiazole
CID 21667472
2-(4-Methylpiperidin-1-yl)thiazole-4-boronic acid
CID 45785534
4-Bromo-2-(4-methylpiperidin-1-YL)thiazole
CID 45787528
2-(3-Methylpiperidin-1-yl)thiazole-4-boronic acid
CID 53398588
4-Chloro-2-(4-methylpiperidin-1-yl)-1,3-thiazole
CID 83156680

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole?
The IUPAC name of 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole (CID 83156082) is 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole.
What is the SMILES notation for 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole?
The canonical SMILES for 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole is CCC1CCN(c2nc(Cl)cs2)CC1.
What is the InChIKey of 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole?
The InChIKey is RWEWYRKPUZYHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2S/c1-2-8-3-5-13(6-4-8)10-12-9(11)7-14-10/h7-8H,2-6H2,1H3.
What are the key properties of 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole?
4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole has a molecular weight of 230.76 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(4-ethylpiperidin-1-yl)-1,3-thiazole is sourced from PubChem (CID 83156082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).