(3,5-dichlorophenyl)-morpholin-4-ylmethanone

C11H11Cl2NO2 — CID 790875

IUPAC(3,5-dichlorophenyl)-morpholin-4-ylmethanone
SMILESO=C(c1cc(Cl)cc(Cl)c1)N1CCOCC1
InChIInChI=1S/C11H11Cl2NO2/c12-9-5-8(6-10(13)7-9)11(15)14-1-3-16-4-2-14/h5-7H,1-4H2
InChIKeyZIIVRPJBTGUDPU-UHFFFAOYSA-N
MW260.12 g/mol
LogP2.47
Rot. Bonds1

About (3,5-dichlorophenyl)-morpholin-4-ylmethanone

(3,5-dichlorophenyl)-morpholin-4-ylmethanone (PubChem CID 790875) has the molecular formula C11H11Cl2NO2 and a molecular weight of 260.12 g/mol. Its IUPAC name is (3,5-dichlorophenyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(3,5-dichlorophenyl)-morpholin-4-ylmethanone
PubChem CID790875
Molecular FormulaC11H11Cl2NO2
Molecular Weight260.12 g/mol
Exact Mass259.02
IUPAC Name(3,5-dichlorophenyl)-morpholin-4-ylmethanone
SMILESO=C(c1cc(Cl)cc(Cl)c1)N1CCOCC1
InChIInChI=1S/C11H11Cl2NO2/c12-9-5-8(6-10(13)7-9)11(15)14-1-3-16-4-2-14/h5-7H,1-4H2
InChIKeyZIIVRPJBTGUDPU-UHFFFAOYSA-N
XLogP2.47
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.12
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3,5-dichlorophenyl)-morpholin-4-ylmethanone?
The IUPAC name of (3,5-dichlorophenyl)-morpholin-4-ylmethanone (CID 790875) is (3,5-dichlorophenyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (3,5-dichlorophenyl)-morpholin-4-ylmethanone?
The canonical SMILES for (3,5-dichlorophenyl)-morpholin-4-ylmethanone is O=C(c1cc(Cl)cc(Cl)c1)N1CCOCC1.
What is the InChIKey of (3,5-dichlorophenyl)-morpholin-4-ylmethanone?
The InChIKey is ZIIVRPJBTGUDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2NO2/c12-9-5-8(6-10(13)7-9)11(15)14-1-3-16-4-2-14/h5-7H,1-4H2.
What are the key properties of (3,5-dichlorophenyl)-morpholin-4-ylmethanone?
(3,5-dichlorophenyl)-morpholin-4-ylmethanone has a molecular weight of 260.12 g/mol, XLogP of 2.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichlorophenyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 790875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).