2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide

C12H14Cl2N2O2 — CID 43822469

IUPAC2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide
SMILESO=C(CCl)Nc1cc(N2CCOCC2)ccc1Cl
InChIInChI=1S/C12H14Cl2N2O2/c13-8-12(17)15-11-7-9(1-2-10(11)14)16-3-5-18-6-4-16/h1-2,7H,3-6,8H2,(H,15,17)
InChIKeyIEKJCIPISHWCLH-UHFFFAOYSA-N
MW289.16 g/mol
LogP2.35
Rot. Bonds3

About 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide

2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide (PubChem CID 43822469) has the molecular formula C12H14Cl2N2O2 and a molecular weight of 289.16 g/mol. Its IUPAC name is 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide
PubChem CID43822469
Molecular FormulaC12H14Cl2N2O2
Molecular Weight289.16 g/mol
Exact Mass288.04
IUPAC Name2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide
SMILESO=C(CCl)Nc1cc(N2CCOCC2)ccc1Cl
InChIInChI=1S/C12H14Cl2N2O2/c13-8-12(17)15-11-7-9(1-2-10(11)14)16-3-5-18-6-4-16/h1-2,7H,3-6,8H2,(H,15,17)
InChIKeyIEKJCIPISHWCLH-UHFFFAOYSA-N
XLogP2.35
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 ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

4-[4-chloro-3-[(2-chloroacetyl)amino]phenyl]piperazine-1-carboxylic acid
CID 18542397
2-chloro-N-(5-chloro-2-morpholin-4-yl-4-pyridinyl)acetamide
CID 139405306
N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide
CID 110362732
N-(2-chloro-5-morpholin-4-ylphenyl)-2,6-dimethoxybenzamide
CID 110362746
2-(4-chlorophenoxy)-N-(2-methyl-5-morpholin-4-ylphenyl)acetamide
CID 110362472
2-chloro-N-(6-morpholin-4-yl-1,3-benzothiazol-2-yl)acetamide
CID 17244599
2-(4-chlorophenyl)-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)acetamide
CID 110400406
3-(2-chloro-5-morpholin-4-ylphenyl)-1-ethyl-1-[(5-methylfuran-2-yl)methyl]urea
CID 118783105
2-chloro-5-morpholin-4-ylphenol
CID 84679971
2-chloro-6-fluoro-N-(2-fluoro-5-morpholin-4-ylphenyl)benzamide
CID 110362632
N-(2-fluoro-5-morpholin-4-ylphenyl)-2-phenylacetamide
CID 110362608
N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-morpholin-4-ylphenyl)acetamide
CID 110427902

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide (CID 43822469) is 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide is O=C(CCl)Nc1cc(N2CCOCC2)ccc1Cl.
What is the InChIKey of 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide?
The InChIKey is IEKJCIPISHWCLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2O2/c13-8-12(17)15-11-7-9(1-2-10(11)14)16-3-5-18-6-4-16/h1-2,7H,3-6,8H2,(H,15,17).
What are the key properties of 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide?
2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide has a molecular weight of 289.16 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 43822469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).