N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide

C15H19ClN2O3 — CID 125141809

IUPACN-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide
SMILESC[C@@H]1CN(C(=O)C(=O)NCCc2ccccc2Cl)CCO1
InChIInChI=1S/C15H19ClN2O3/c1-11-10-18(8-9-21-11)15(20)14(19)17-7-6-12-4-2-3-5-13(12)16/h2-5,11H,6-10H2,1H3,(H,17,19)/t11-/m1/s1
InChIKeyBPLYENSAOBSVDX-LLVKDONJSA-N
MW310.78 g/mol
LogP1.25
Rot. Bonds3

About N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide

N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide (PubChem CID 125141809) has the molecular formula C15H19ClN2O3 and a molecular weight of 310.78 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide
PubChem CID125141809
Molecular FormulaC15H19ClN2O3
Molecular Weight310.78 g/mol
Exact Mass310.11
IUPAC NameN-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide
SMILESC[C@@H]1CN(C(=O)C(=O)NCCc2ccccc2Cl)CCO1
InChIInChI=1S/C15H19ClN2O3/c1-11-10-18(8-9-21-11)15(20)14(19)17-7-6-12-4-2-3-5-13(12)16/h2-5,11H,6-10H2,1H3,(H,17,19)/t11-/m1/s1
InChIKeyBPLYENSAOBSVDX-LLVKDONJSA-N
XLogP1.25
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.78
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(2-chlorophenyl)methyl]-2-(2,6-dimethylmorpholin-4-yl)-2-oxoacetamide
CID 108503887
2-[(2R)-2-methylmorpholin-4-yl]-2-oxo-N-[(1R)-1-phenylethyl]acetamide
CID 125141946
[5-(2-chlorophenyl)furan-2-yl]-[(2R)-2-methylmorpholin-4-yl]methanone
CID 42000409
(2-bromo-6-chlorophenyl)-[(2R)-2-methylmorpholin-4-yl]methanone
CID 172647342
[2-[2-(2,6-dichloroanilino)phenyl]acetyl]oxymethyl 2-methylmorpholine-4-carboxylate
CID 170335307
(2-bromo-3-chlorophenyl)-[(2R)-2-methylmorpholin-4-yl]methanone
CID 172647316
(2-chloro-6-iodophenyl)-[(2S)-2-methylmorpholin-4-yl]methanone
CID 172647236
4-[(2-chlorophenyl)methylsulfonyl]-2-methylmorpholine
CID 110292466
(2-chloro-6-fluorophenyl)-(2-methylmorpholin-4-yl)methanone
CID 52985815
(2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide
CID 95760502
N-[2-(2-methoxyphenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide
CID 134055335
2-[2-(2-chlorophenoxy)anilino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
CID 32904994

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide?
The IUPAC name of N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide (CID 125141809) is N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide.
What is the SMILES notation for N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide?
The canonical SMILES for N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide is C[C@@H]1CN(C(=O)C(=O)NCCc2ccccc2Cl)CCO1.
What is the InChIKey of N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide?
The InChIKey is BPLYENSAOBSVDX-LLVKDONJSA-N. The full InChI is InChI=1S/C15H19ClN2O3/c1-11-10-18(8-9-21-11)15(20)14(19)17-7-6-12-4-2-3-5-13(12)16/h2-5,11H,6-10H2,1H3,(H,17,19)/t11-/m1/s1.
What are the key properties of N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide?
N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide has a molecular weight of 310.78 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]-2-oxoacetamide is sourced from PubChem (CID 125141809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).