[1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone

C15H20N2O3S — CID 110394387

IUPAC[1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)C1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H20N2O3S/c18-14(13-2-1-11-21-13)12-3-5-16(6-4-12)15(19)17-7-9-20-10-8-17/h1-2,11-12H,3-10H2
InChIKeyXEVFUDRVACXRRA-UHFFFAOYSA-N
MW308.40 g/mol
LogP2.10
Rot. Bonds2

About [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone

[1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone (PubChem CID 110394387) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone.

Molecular Properties

Compound Name[1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone
PubChem CID110394387
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC Name[1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)C1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H20N2O3S/c18-14(13-2-1-11-21-13)12-3-5-16(6-4-12)15(19)17-7-9-20-10-8-17/h1-2,11-12H,3-10H2
InChIKeyXEVFUDRVACXRRA-UHFFFAOYSA-N
XLogP2.10
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone?
The IUPAC name of [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone (CID 110394387) is [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone.
What is the SMILES notation for [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone?
The canonical SMILES for [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone is O=C(c1cccs1)C1CCN(C(=O)N2CCOCC2)CC1.
What is the InChIKey of [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone?
The InChIKey is XEVFUDRVACXRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c18-14(13-2-1-11-21-13)12-3-5-16(6-4-12)15(19)17-7-9-20-10-8-17/h1-2,11-12H,3-10H2.
What are the key properties of [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone?
[1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone has a molecular weight of 308.40 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(morpholine-4-carbonyl)piperidin-4-yl]-thiophen-2-ylmethanone is sourced from PubChem (CID 110394387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).