3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide

C12H19N3O2S — CID 55251443

IUPAC3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide
SMILESO=C(CCOC1CCNCC1)NCc1nccs1
InChIInChI=1S/C12H19N3O2S/c16-11(15-9-12-14-6-8-18-12)3-7-17-10-1-4-13-5-2-10/h6,8,10,13H,1-5,7,9H2,(H,15,16)
InChIKeyKIANEBKJMUUAKX-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.92
Rot. Bonds6

About 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide

3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide (PubChem CID 55251443) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide
PubChem CID55251443
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide
SMILESO=C(CCOC1CCNCC1)NCc1nccs1
InChIInChI=1S/C12H19N3O2S/c16-11(15-9-12-14-6-8-18-12)3-7-17-10-1-4-13-5-2-10/h6,8,10,13H,1-5,7,9H2,(H,15,16)
InChIKeyKIANEBKJMUUAKX-UHFFFAOYSA-N
XLogP0.92
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide?
The IUPAC name of 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide (CID 55251443) is 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide.
What is the SMILES notation for 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide?
The canonical SMILES for 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide is O=C(CCOC1CCNCC1)NCc1nccs1.
What is the InChIKey of 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide?
The InChIKey is KIANEBKJMUUAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c16-11(15-9-12-14-6-8-18-12)3-7-17-10-1-4-13-5-2-10/h6,8,10,13H,1-5,7,9H2,(H,15,16).
What are the key properties of 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide?
3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide has a molecular weight of 269.37 g/mol, XLogP of 0.92, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yloxy-N-(1,3-thiazol-2-ylmethyl)propanamide is sourced from PubChem (CID 55251443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).