2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide

C12H19N3O2S — CID 66428336

IUPAC2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide
SMILESCCC(NC(=O)CC1CNCCO1)c1nccs1
InChIInChI=1S/C12H19N3O2S/c1-2-10(12-14-4-6-18-12)15-11(16)7-9-8-13-3-5-17-9/h4,6,9-10,13H,2-3,5,7-8H2,1H3,(H,15,16)
InChIKeyWDNFETMSCCGNEE-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.09
Rot. Bonds5

About 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide

2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide (PubChem CID 66428336) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide.

Molecular Properties

Compound Name2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide
PubChem CID66428336
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide
SMILESCCC(NC(=O)CC1CNCCO1)c1nccs1
InChIInChI=1S/C12H19N3O2S/c1-2-10(12-14-4-6-18-12)15-11(16)7-9-8-13-3-5-17-9/h4,6,9-10,13H,2-3,5,7-8H2,1H3,(H,15,16)
InChIKeyWDNFETMSCCGNEE-UHFFFAOYSA-N
XLogP1.09
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide?
The IUPAC name of 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide (CID 66428336) is 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide.
What is the SMILES notation for 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide?
The canonical SMILES for 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide is CCC(NC(=O)CC1CNCCO1)c1nccs1.
What is the InChIKey of 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide?
The InChIKey is WDNFETMSCCGNEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-2-10(12-14-4-6-18-12)15-11(16)7-9-8-13-3-5-17-9/h4,6,9-10,13H,2-3,5,7-8H2,1H3,(H,15,16).
What are the key properties of 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide?
2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide has a molecular weight of 269.37 g/mol, XLogP of 1.09, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-2-yl-N-[1-(1,3-thiazol-2-yl)propyl]acetamide is sourced from PubChem (CID 66428336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).