(3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

C18H24F2N2O2 — CID 53193425

IUPAC(3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)c(F)c1)N1CCCCC1CCN1CCOCC1
InChIInChI=1S/C18H24F2N2O2/c19-16-5-4-14(13-17(16)20)18(23)22-7-2-1-3-15(22)6-8-21-9-11-24-12-10-21/h4-5,13,15H,1-3,6-12H2
InChIKeyUOSWPLJQFQUYPV-UHFFFAOYSA-N
MW338.40 g/mol
LogP2.68
Rot. Bonds4

About (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

(3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone (PubChem CID 53193425) has the molecular formula C18H24F2N2O2 and a molecular weight of 338.40 g/mol. Its IUPAC name is (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
PubChem CID53193425
Molecular FormulaC18H24F2N2O2
Molecular Weight338.40 g/mol
Exact Mass338.18
IUPAC Name(3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)c(F)c1)N1CCCCC1CCN1CCOCC1
InChIInChI=1S/C18H24F2N2O2/c19-16-5-4-14(13-17(16)20)18(23)22-7-2-1-3-15(22)6-8-21-9-11-24-12-10-21/h4-5,13,15H,1-3,6-12H2
InChIKeyUOSWPLJQFQUYPV-UHFFFAOYSA-N
XLogP2.68
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.40
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Bavisant
CID 16061509
N-Benzoylmorpholine
CID 15114
Benzamide, 4-fluoro-N-(2-(4-morpholinyl)ethyl)-
CID 835134
N,N-dicyclohexyl-2,6-difluorobenzamide
CID 875986
(4-Cyclobutylpiperazin-1-yl)-[4-[(4-fluoropiperidin-1-yl)methyl]phenyl]methanone
CID 59218190
4-(2,3-Difluoro-4-methylbenzoyl)morpholine
CID 2210872
N-(N-benzylpiperidin-4-yl)-2-fluorobenzamide
CID 825648
N-(2-Fluorobenzoyl)morpholine
CID 531931
N-(4-Fluorobenzoyl)morpholine
CID 531951
(2-Fluorophenyl)-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]methanone
CID 754219
4-[(4-Benzoyl-1-piperazinyl)sulfonyl]morpholine
CID 973813
(3-Fluorophenyl)[3-(piperidin-1-ylcarbonyl)piperidin-1-yl]methanone
CID 3769094

Frequently Asked Questions

What is the IUPAC name of (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The IUPAC name of (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone (CID 53193425) is (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The canonical SMILES for (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone is O=C(c1ccc(F)c(F)c1)N1CCCCC1CCN1CCOCC1.
What is the InChIKey of (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The InChIKey is UOSWPLJQFQUYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24F2N2O2/c19-16-5-4-14(13-17(16)20)18(23)22-7-2-1-3-15(22)6-8-21-9-11-24-12-10-21/h4-5,13,15H,1-3,6-12H2.
What are the key properties of (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
(3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone has a molecular weight of 338.40 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 53193425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).