N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide

C15H24ClN3OS — CID 72916140

IUPACN-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(CC(=O)NCCc2nc(C)c(Cl)s2)CC1
InChIInChI=1S/C15H24ClN3OS/c1-3-19-8-5-12(6-9-19)10-13(20)17-7-4-14-18-11(2)15(16)21-14/h12H,3-10H2,1-2H3,(H,17,20)
InChIKeyQAPREKKCALWELZ-UHFFFAOYSA-N
MW329.90 g/mol
LogP2.89
Rot. Bonds6

About N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide

N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide (PubChem CID 72916140) has the molecular formula C15H24ClN3OS and a molecular weight of 329.90 g/mol. Its IUPAC name is N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide
PubChem CID72916140
Molecular FormulaC15H24ClN3OS
Molecular Weight329.90 g/mol
Exact Mass329.13
IUPAC NameN-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(CC(=O)NCCc2nc(C)c(Cl)s2)CC1
InChIInChI=1S/C15H24ClN3OS/c1-3-19-8-5-12(6-9-19)10-13(20)17-7-4-14-18-11(2)15(16)21-14/h12H,3-10H2,1-2H3,(H,17,20)
InChIKeyQAPREKKCALWELZ-UHFFFAOYSA-N
XLogP2.89
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.90
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethylpiperidin-4-yl)-N-[(4-methyl-2-propyl-1,3-thiazol-5-yl)methyl]acetamide
CID 72919535
(3R)-N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-1-ethyl-5-oxopyrrolidine-3-carboxamide
CID 97192188
(3S)-N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 97282796
N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 70762923
N-[3-(1,3-dihydroisoindol-2-yl)propyl]-2-(1-ethylpiperidin-4-yl)acetamide
CID 72894922
(2R)-N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-pyrazol-1-ylbutanamide
CID 97141074
N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 72837875
2-(1-ethylpiperidin-4-yl)-N-propan-2-ylacetamide
CID 177202345
2-(1-ethylpiperidin-4-yl)-N-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methyl]acetamide
CID 72939700
N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]-2-thiomorpholin-3-ylacetamide
CID 119942335
2-cyclopentyl-N-[(2-ethyl-6-methylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]acetamide
CID 53163361
N-[2-(5-cyano-2-methyl-1H-indol-3-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide
CID 72854273

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide?
The IUPAC name of N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide (CID 72916140) is N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide?
The canonical SMILES for N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide is CCN1CCC(CC(=O)NCCc2nc(C)c(Cl)s2)CC1.
What is the InChIKey of N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide?
The InChIKey is QAPREKKCALWELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClN3OS/c1-3-19-8-5-12(6-9-19)10-13(20)17-7-4-14-18-11(2)15(16)21-14/h12H,3-10H2,1-2H3,(H,17,20).
What are the key properties of N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide?
N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide has a molecular weight of 329.90 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-chloro-4-methyl-1,3-thiazol-2-yl)ethyl]-2-(1-ethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 72916140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).