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

C12H19N3O2S — CID 55251350

IUPAC3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide
SMILESO=C(CCOC1CCNCC1)NCc1cscn1
InChIInChI=1S/C12H19N3O2S/c16-12(14-7-10-8-18-9-15-10)3-6-17-11-1-4-13-5-2-11/h8-9,11,13H,1-7H2,(H,14,16)
InChIKeyPFLOAJYBUUBDNH-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.92
Rot. Bonds6

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

3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide (PubChem CID 55251350) 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-4-ylmethyl)propanamide.

Molecular Properties

Compound Name3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide
PubChem CID55251350
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide
SMILESO=C(CCOC1CCNCC1)NCc1cscn1
InChIInChI=1S/C12H19N3O2S/c16-12(14-7-10-8-18-9-15-10)3-6-17-11-1-4-13-5-2-11/h8-9,11,13H,1-7H2,(H,14,16)
InChIKeyPFLOAJYBUUBDNH-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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Related Compounds

2-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 63902488
3-piperidin-4-yloxy-N-(thiophen-3-ylmethyl)propanamide
CID 63905466
3-piperidin-4-yloxy-N-(pyridin-4-ylmethyl)propanamide
CID 63875784
3-[1-(1,3-thiazol-4-ylmethylcarbamoyl)piperidin-4-yl]oxypropanoic acid
CID 63876641
N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide
CID 63902997
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide
CID 106371168
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-3-piperidin-4-yloxypropanamide
CID 63877198
2-pyrrolidin-2-yl-N-(1,3-thiazol-4-ylmethyl)acetamide
CID 63824820
N-(2-amino-2-oxoethyl)-3-piperidin-4-yloxypropanamide
CID 63875429
3-piperidin-4-yloxy-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide
CID 64530751
4-chloro-N-(1,3-thiazol-4-ylmethyl)butanamide
CID 63831533
N-[(3-chloro-4-fluorophenyl)methyl]-3-piperidin-4-yloxypropanamide
CID 63905458

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide?
The IUPAC name of 3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide (CID 55251350) is 3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide.
What is the SMILES notation for 3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide?
The canonical SMILES for 3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide is O=C(CCOC1CCNCC1)NCc1cscn1.
What is the InChIKey of 3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide?
The InChIKey is PFLOAJYBUUBDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c16-12(14-7-10-8-18-9-15-10)3-6-17-11-1-4-13-5-2-11/h8-9,11,13H,1-7H2,(H,14,16).
What are the key properties of 3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide?
3-piperidin-4-yloxy-N-(1,3-thiazol-4-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-4-ylmethyl)propanamide is sourced from PubChem (CID 55251350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).