(3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone

C14H20N2O2S — CID 24817426

IUPAC(3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)N1CCCC(N2CCOCC2)C1
InChIInChI=1S/C14H20N2O2S/c17-14(12-3-9-19-11-12)16-4-1-2-13(10-16)15-5-7-18-8-6-15/h3,9,11,13H,1-2,4-8,10H2
InChIKeyCZBGFFZKAMSORE-UHFFFAOYSA-N
MW280.39 g/mol
LogP1.68
Rot. Bonds2

About (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone

(3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone (PubChem CID 24817426) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone.

Molecular Properties

Compound Name(3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone
PubChem CID24817426
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC Name(3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)N1CCCC(N2CCOCC2)C1
InChIInChI=1S/C14H20N2O2S/c17-14(12-3-9-19-11-12)16-4-1-2-13(10-16)15-5-7-18-8-6-15/h3,9,11,13H,1-2,4-8,10H2
InChIKeyCZBGFFZKAMSORE-UHFFFAOYSA-N
XLogP1.68
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone?
The IUPAC name of (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone (CID 24817426) is (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone.
What is the SMILES notation for (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone?
The canonical SMILES for (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone is O=C(c1ccsc1)N1CCCC(N2CCOCC2)C1.
What is the InChIKey of (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone?
The InChIKey is CZBGFFZKAMSORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2S/c17-14(12-3-9-19-11-12)16-4-1-2-13(10-16)15-5-7-18-8-6-15/h3,9,11,13H,1-2,4-8,10H2.
What are the key properties of (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone?
(3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone has a molecular weight of 280.39 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-morpholin-4-ylpiperidin-1-yl)-thiophen-3-ylmethanone is sourced from PubChem (CID 24817426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).