N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide

C12H14Cl2N2O2 — CID 735642

IUPACN-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H14Cl2N2O2/c13-9-1-2-10(14)11(7-9)15-12(17)8-16-3-5-18-6-4-16/h1-2,7H,3-6,8H2,(H,15,17)
InChIKeyZIWXUBMODWBKQB-UHFFFAOYSA-N
MW289.16 g/mol
LogP2.26
Rot. Bonds3

About N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide

N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide (PubChem CID 735642) has the molecular formula C12H14Cl2N2O2 and a molecular weight of 289.16 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide
PubChem CID735642
Molecular FormulaC12H14Cl2N2O2
Molecular Weight289.16 g/mol
Exact Mass288.04
IUPAC NameN-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide
SMILESO=C(CN1CCOCC1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H14Cl2N2O2/c13-9-1-2-10(14)11(7-9)15-12(17)8-16-3-5-18-6-4-16/h1-2,7H,3-6,8H2,(H,15,17)
InChIKeyZIWXUBMODWBKQB-UHFFFAOYSA-N
XLogP2.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.16
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide (CID 735642) is N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide is O=C(CN1CCOCC1)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide?
The InChIKey is ZIWXUBMODWBKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2O2/c13-9-1-2-10(14)11(7-9)15-12(17)8-16-3-5-18-6-4-16/h1-2,7H,3-6,8H2,(H,15,17).
What are the key properties of N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide?
N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide has a molecular weight of 289.16 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-morpholin-4-ylacetamide is sourced from PubChem (CID 735642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).