2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide

C12H20N4OS — CID 62800166

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide
SMILESCCN1CCCC(NC(=O)Cc2csc(N)n2)C1
InChIInChI=1S/C12H20N4OS/c1-2-16-5-3-4-9(7-16)14-11(17)6-10-8-18-12(13)15-10/h8-9H,2-7H2,1H3,(H2,13,15)(H,14,17)
InChIKeyWMHANLPXDCBTBY-UHFFFAOYSA-N
MW268.39 g/mol
LogP0.87
Rot. Bonds4

About 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide

2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide (PubChem CID 62800166) has the molecular formula C12H20N4OS and a molecular weight of 268.39 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide
PubChem CID62800166
Molecular FormulaC12H20N4OS
Molecular Weight268.39 g/mol
Exact Mass268.14
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide
SMILESCCN1CCCC(NC(=O)Cc2csc(N)n2)C1
InChIInChI=1S/C12H20N4OS/c1-2-16-5-3-4-9(7-16)14-11(17)6-10-8-18-12(13)15-10/h8-9H,2-7H2,1H3,(H2,13,15)(H,14,17)
InChIKeyWMHANLPXDCBTBY-UHFFFAOYSA-N
XLogP0.87
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.39
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-amino-1,3-thiazol-4-yl)-N-(1-methylsulfonylpiperidin-4-yl)acetamide
CID 62799943
2-(2-amino-1,3-thiazol-4-yl)-N-(4-hydroxycyclohexyl)acetamide
CID 62797099
2-(2-amino-1,3-thiazol-4-yl)-N-[(1-methylpyrrolidin-2-yl)methyl]acetamide
CID 106026146
N-[(3S)-1-(2-phenylethyl)piperidin-3-yl]-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 26392211
N-(1-benzylpiperidin-3-yl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 55655382
3-amino-N-(1-ethylpiperidin-3-yl)-3-methylbutanamide
CID 64677785
N-(1-ethylpiperidin-3-yl)-2-(4-sulfanylphenyl)acetamide
CID 107025229
2-(2-amino-1,3-thiazol-4-yl)-N-(1-methyl-2-oxopyrrolidin-3-yl)acetamide
CID 106255793
3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-N-cyclopropylpropanamide
CID 79401067
2-(4-aminopyrazol-1-yl)-N-(1-ethylpiperidin-3-yl)acetamide
CID 61171325
2-(4-cyanophenyl)-N-(1-ethylpiperidin-3-yl)acetamide
CID 62404425
2-(2-amino-1,3-thiazol-4-yl)-N-[(1-methylpiperidin-2-yl)methyl]acetamide
CID 55120129

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide (CID 62800166) is 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide is CCN1CCCC(NC(=O)Cc2csc(N)n2)C1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide?
The InChIKey is WMHANLPXDCBTBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4OS/c1-2-16-5-3-4-9(7-16)14-11(17)6-10-8-18-12(13)15-10/h8-9H,2-7H2,1H3,(H2,13,15)(H,14,17).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide has a molecular weight of 268.39 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-3-yl)acetamide is sourced from PubChem (CID 62800166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).