2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide

C12H20N4OS — CID 64992990

IUPAC2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide
SMILESCC(NC1CCN(CC(N)=O)CC1)c1nccs1
InChIInChI=1S/C12H20N4OS/c1-9(12-14-4-7-18-12)15-10-2-5-16(6-3-10)8-11(13)17/h4,7,9-10,15H,2-3,5-6,8H2,1H3,(H2,13,17)
InChIKeyGBDBYBOAYKADDO-UHFFFAOYSA-N
MW268.39 g/mol
LogP0.74
Rot. Bonds5

About 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide

2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide (PubChem CID 64992990) has the molecular formula C12H20N4OS and a molecular weight of 268.39 g/mol. Its IUPAC name is 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide
PubChem CID64992990
Molecular FormulaC12H20N4OS
Molecular Weight268.39 g/mol
Exact Mass268.14
IUPAC Name2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide
SMILESCC(NC1CCN(CC(N)=O)CC1)c1nccs1
InChIInChI=1S/C12H20N4OS/c1-9(12-14-4-7-18-12)15-10-2-5-16(6-3-10)8-11(13)17/h4,7,9-10,15H,2-3,5-6,8H2,1H3,(H2,13,17)
InChIKeyGBDBYBOAYKADDO-UHFFFAOYSA-N
XLogP0.74
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.39
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(1-pyridin-4-ylethylamino)piperidin-1-yl]acetamide
CID 43746847
2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide
CID 113260068
2-[4-[acetamido(1,3-thiazol-2-yl)methyl]piperidin-1-yl]acetamide
CID 110090225
4-[[(1S)-1-(1,3-thiazol-2-yl)ethyl]amino]cyclohexan-1-ol
CID 96824330
2-[4-[1-(3,5-dimethylphenyl)ethylamino]piperidin-1-yl]acetamide
CID 81297527
4-[2-(1,3-thiazol-2-yl)propylamino]piperidine-1-carboxamide
CID 104584924
tert-butyl (3R)-3-[1-(1,3-thiazol-2-yl)ethylamino]pyrrolidine-1-carboxylate
CID 71633325
2-[4-[[(1S)-1-pyridin-4-ylethyl]carbamoylamino]piperidin-1-yl]acetamide
CID 95159118
2-[4-[1-(5-fluoro-3-pyridinyl)ethylamino]piperidin-1-yl]acetamide
CID 103776848
4-propan-2-yl-N-[1-(1,3-thiazol-2-yl)ethyl]cycloheptan-1-amine
CID 65090996
N-[1-(1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexan-3-amine
CID 130941268
2-(1-ethylpiperidin-4-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide
CID 72845666

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide (CID 64992990) is 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide is CC(NC1CCN(CC(N)=O)CC1)c1nccs1.
What is the InChIKey of 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide?
The InChIKey is GBDBYBOAYKADDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4OS/c1-9(12-14-4-7-18-12)15-10-2-5-16(6-3-10)8-11(13)17/h4,7,9-10,15H,2-3,5-6,8H2,1H3,(H2,13,17).
What are the key properties of 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide?
2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide has a molecular weight of 268.39 g/mol, XLogP of 0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide is sourced from PubChem (CID 64992990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).