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

C12H20N4O2S — CID 55120172

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
SMILESCC(CN1CCOCC1)NC(=O)Cc1csc(N)n1
InChIInChI=1S/C12H20N4O2S/c1-9(7-16-2-4-18-5-3-16)14-11(17)6-10-8-19-12(13)15-10/h8-9H,2-7H2,1H3,(H2,13,15)(H,14,17)
InChIKeyCXHTUNASZMXGHD-UHFFFAOYSA-N
MW284.38 g/mol
LogP0.10
Rot. Bonds5

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

2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide (PubChem CID 55120172) has the molecular formula C12H20N4O2S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
PubChem CID55120172
Molecular FormulaC12H20N4O2S
Molecular Weight284.38 g/mol
Exact Mass284.13
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
SMILESCC(CN1CCOCC1)NC(=O)Cc1csc(N)n1
InChIInChI=1S/C12H20N4O2S/c1-9(7-16-2-4-18-5-3-16)14-11(17)6-10-8-19-12(13)15-10/h8-9H,2-7H2,1H3,(H2,13,15)(H,14,17)
InChIKeyCXHTUNASZMXGHD-UHFFFAOYSA-N
XLogP0.10
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide (CID 55120172) is 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide is CC(CN1CCOCC1)NC(=O)Cc1csc(N)n1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The InChIKey is CXHTUNASZMXGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-9(7-16-2-4-18-5-3-16)14-11(17)6-10-8-19-12(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-morpholin-4-ylpropan-2-yl)acetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide has a molecular weight of 284.38 g/mol, XLogP of 0.10, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide is sourced from PubChem (CID 55120172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).