(2,5-dichlorophenyl)-morpholin-4-ylmethanone

C11H11Cl2NO2 — CID 868908

IUPAC(2,5-dichlorophenyl)-morpholin-4-ylmethanone
SMILESO=C(c1cc(Cl)ccc1Cl)N1CCOCC1
InChIInChI=1S/C11H11Cl2NO2/c12-8-1-2-10(13)9(7-8)11(15)14-3-5-16-6-4-14/h1-2,7H,3-6H2
InChIKeySWVWLULVLDQSSF-UHFFFAOYSA-N
MW260.12 g/mol
LogP2.47
Rot. Bonds1

About (2,5-dichlorophenyl)-morpholin-4-ylmethanone

(2,5-dichlorophenyl)-morpholin-4-ylmethanone (PubChem CID 868908) has the molecular formula C11H11Cl2NO2 and a molecular weight of 260.12 g/mol. Its IUPAC name is (2,5-dichlorophenyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2,5-dichlorophenyl)-morpholin-4-ylmethanone
PubChem CID868908
Molecular FormulaC11H11Cl2NO2
Molecular Weight260.12 g/mol
Exact Mass259.02
IUPAC Name(2,5-dichlorophenyl)-morpholin-4-ylmethanone
SMILESO=C(c1cc(Cl)ccc1Cl)N1CCOCC1
InChIInChI=1S/C11H11Cl2NO2/c12-8-1-2-10(13)9(7-8)11(15)14-3-5-16-6-4-14/h1-2,7H,3-6H2
InChIKeySWVWLULVLDQSSF-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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Related Compounds

Moclobemide
CID 4235
4-Chloro-N-(3-(4-morpholinyl)propyl)benzamide
CID 65659
N-Benzoylmorpholine
CID 15114
4-(2-Chlorobenzoyl)-morpholine
CID 225451
2,5-dichloro-N-(2-morpholin-4-ylethyl)benzamide
CID 567688
2-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide
CID 799090
4-(3,5-Dichlorobenzoyl)morpholine
CID 790875
2-(2-Chlorophenyl)-1-morpholin-4-ylethanone
CID 1245975
1-(3-Chlorobenzoyl)-4-methylpiperazine
CID 550876
2,5-dichloro-N-(3-morpholin-4-ylpropyl)benzamide
CID 2162726
2,4-dichloro-N-[3-(morpholin-4-yl)propyl]benzamide
CID 2165284
3-chloro-4-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 2269216

Frequently Asked Questions

What is the IUPAC name of (2,5-dichlorophenyl)-morpholin-4-ylmethanone?
The IUPAC name of (2,5-dichlorophenyl)-morpholin-4-ylmethanone (CID 868908) is (2,5-dichlorophenyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2,5-dichlorophenyl)-morpholin-4-ylmethanone?
The canonical SMILES for (2,5-dichlorophenyl)-morpholin-4-ylmethanone is O=C(c1cc(Cl)ccc1Cl)N1CCOCC1.
What is the InChIKey of (2,5-dichlorophenyl)-morpholin-4-ylmethanone?
The InChIKey is SWVWLULVLDQSSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2NO2/c12-8-1-2-10(13)9(7-8)11(15)14-3-5-16-6-4-14/h1-2,7H,3-6H2.
What are the key properties of (2,5-dichlorophenyl)-morpholin-4-ylmethanone?
(2,5-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 (2,5-dichlorophenyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 868908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).