[1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone

C16H25F2N3O3 — CID 146145421

IUPAC[1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(C(=O)N2CCC(F)(F)CC2)CC1)N1CCOCC1
InChIInChI=1S/C16H25F2N3O3/c17-16(18)3-7-21(8-4-16)15(23)20-5-1-13(2-6-20)14(22)19-9-11-24-12-10-19/h13H,1-12H2
InChIKeyUTCANPFXLWPACU-UHFFFAOYSA-N
MW345.39 g/mol
LogP1.41
Rot. Bonds1

About [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone

[1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 146145421) has the molecular formula C16H25F2N3O3 and a molecular weight of 345.39 g/mol. Its IUPAC name is [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID146145421
Molecular FormulaC16H25F2N3O3
Molecular Weight345.39 g/mol
Exact Mass345.19
IUPAC Name[1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(C(=O)N2CCC(F)(F)CC2)CC1)N1CCOCC1
InChIInChI=1S/C16H25F2N3O3/c17-16(18)3-7-21(8-4-16)15(23)20-5-1-13(2-6-20)14(22)19-9-11-24-12-10-19/h13H,1-12H2
InChIKeyUTCANPFXLWPACU-UHFFFAOYSA-N
XLogP1.41
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.39
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone (CID 146145421) is [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone is O=C(C1CCN(C(=O)N2CCC(F)(F)CC2)CC1)N1CCOCC1.
What is the InChIKey of [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is UTCANPFXLWPACU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25F2N3O3/c17-16(18)3-7-21(8-4-16)15(23)20-5-1-13(2-6-20)14(22)19-9-11-24-12-10-19/h13H,1-12H2.
What are the key properties of [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone?
[1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 345.39 g/mol, XLogP of 1.41, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4,4-difluoropiperidine-1-carbonyl)piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 146145421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).