2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide

C12H20N4OS — CID 113260068

IUPAC2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide
SMILESCC(NC1CCN(CC(N)=O)CC1)c1cncs1
InChIInChI=1S/C12H20N4OS/c1-9(11-6-14-8-18-11)15-10-2-4-16(5-3-10)7-12(13)17/h6,8-10,15H,2-5,7H2,1H3,(H2,13,17)
InChIKeyOHEGWWMEYQYIID-UHFFFAOYSA-N
MW268.39 g/mol
LogP0.74
Rot. Bonds5

About 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide

2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide (PubChem CID 113260068) has the molecular formula C12H20N4OS and a molecular weight of 268.39 g/mol. Its IUPAC name is 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide
PubChem CID113260068
Molecular FormulaC12H20N4OS
Molecular Weight268.39 g/mol
Exact Mass268.14
IUPAC Name2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide
SMILESCC(NC1CCN(CC(N)=O)CC1)c1cncs1
InChIInChI=1S/C12H20N4OS/c1-9(11-6-14-8-18-11)15-10-2-4-16(5-3-10)7-12(13)17/h6,8-10,15H,2-5,7H2,1H3,(H2,13,17)
InChIKeyOHEGWWMEYQYIID-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-(1,3-thiazol-2-yl)ethylamino]piperidin-1-yl]acetamide
CID 64992990
2-[4-(1-pyridin-4-ylethylamino)piperidin-1-yl]acetamide
CID 43746847
2-[4-(1,3-thiazol-5-ylmethylamino)piperidin-1-yl]acetamide
CID 62759264
2-[4-[1-(5-fluoro-3-pyridinyl)ethylamino]piperidin-1-yl]acetamide
CID 103776848
2-[4-[1-(3,5-dimethylphenyl)ethylamino]piperidin-1-yl]acetamide
CID 81297527
1-cyclopropyl-N-[1-(1,3-thiazol-5-yl)ethyl]pyrrolidin-3-amine
CID 115717113
N-[1-(1,3-thiazol-5-yl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 113260246
2-[4-(pentan-3-ylamino)piperidin-1-yl]acetamide
CID 43746855
2-[4-[1-(5-bromo-2-fluorophenyl)ethylamino]piperidin-1-yl]acetamide
CID 81298064
2-[4-[1-(4-hydroxyphenyl)propan-2-ylamino]piperidin-1-yl]acetamide
CID 115494179
2-[4-[[(1S)-1-pyridin-4-ylethyl]carbamoylamino]piperidin-1-yl]acetamide
CID 95159118
N-methyl-2-[4-[1-(1,3-thiazol-4-yl)ethylamino]piperidin-1-yl]acetamide
CID 115879016

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide (CID 113260068) is 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide is CC(NC1CCN(CC(N)=O)CC1)c1cncs1.
What is the InChIKey of 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide?
The InChIKey is OHEGWWMEYQYIID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4OS/c1-9(11-6-14-8-18-11)15-10-2-4-16(5-3-10)7-12(13)17/h6,8-10,15H,2-5,7H2,1H3,(H2,13,17).
What are the key properties of 2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide?
2-[4-[1-(1,3-thiazol-5-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-5-yl)ethylamino]piperidin-1-yl]acetamide is sourced from PubChem (CID 113260068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).