2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide

C15H21ClN2O3 — CID 132776542

IUPAC2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide
SMILESCOCC1(CC(N)=O)CN(Cc2ccc(Cl)cc2)CCO1
InChIInChI=1S/C15H21ClN2O3/c1-20-11-15(8-14(17)19)10-18(6-7-21-15)9-12-2-4-13(16)5-3-12/h2-5H,6-11H2,1H3,(H2,17,19)
InChIKeyZTFVVSPHOSKNDW-UHFFFAOYSA-N
MW312.80 g/mol
LogP1.43
Rot. Bonds6

About 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide

2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide (PubChem CID 132776542) has the molecular formula C15H21ClN2O3 and a molecular weight of 312.80 g/mol. Its IUPAC name is 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide
PubChem CID132776542
Molecular FormulaC15H21ClN2O3
Molecular Weight312.80 g/mol
Exact Mass312.12
IUPAC Name2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide
SMILESCOCC1(CC(N)=O)CN(Cc2ccc(Cl)cc2)CCO1
InChIInChI=1S/C15H21ClN2O3/c1-20-11-15(8-14(17)19)10-18(6-7-21-15)9-12-2-4-13(16)5-3-12/h2-5H,6-11H2,1H3,(H2,17,19)
InChIKeyZTFVVSPHOSKNDW-UHFFFAOYSA-N
XLogP1.43
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.80
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2R)-4-benzyl-2-[(3-chlorophenoxy)methyl]morpholin-2-yl]acetamide
CID 124960032
2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide
CID 124992315
2-[2-[(4-chlorophenoxy)methyl]-4-[2-(4-chlorophenyl)acetyl]morpholin-2-yl]acetamide
CID 132772464
2-[4-[(2-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]-N,N-dimethylacetamide
CID 132777170
2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(2,4-difluorophenyl)methyl]morpholin-2-yl]acetamide
CID 124947580
2-[(2S)-2-[(3-chlorophenoxy)methyl]-4-[(2,4-difluorophenyl)methyl]morpholin-2-yl]acetamide
CID 124947579
2-[(2S)-2-[(3-chlorophenoxy)methyl]-4-[(3-methylthiophen-2-yl)methyl]morpholin-2-yl]acetamide
CID 124962637
2-[(2S)-2-[(3-chlorophenoxy)methyl]-4-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]morpholin-2-yl]acetamide
CID 124995316
2-[2-[(3-chlorophenoxy)methyl]-4-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]morpholin-2-yl]acetamide
CID 110081882
2-[2-[(3-chlorophenoxy)methyl]-4-(3-phenylpropyl)morpholin-2-yl]acetamide
CID 110081867
2-[2-[(4-chlorophenoxy)methyl]-4-[2-(4-propan-2-ylpiperazin-1-yl)acetyl]morpholin-2-yl]acetamide
CID 132772866
2-[2-[(3-chlorophenoxy)methyl]-4-[[1-(2-chlorophenyl)pyrrol-2-yl]methyl]morpholin-2-yl]acetamide
CID 110081896

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide?
The IUPAC name of 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide (CID 132776542) is 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide.
What is the SMILES notation for 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide?
The canonical SMILES for 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide is COCC1(CC(N)=O)CN(Cc2ccc(Cl)cc2)CCO1.
What is the InChIKey of 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide?
The InChIKey is ZTFVVSPHOSKNDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O3/c1-20-11-15(8-14(17)19)10-18(6-7-21-15)9-12-2-4-13(16)5-3-12/h2-5H,6-11H2,1H3,(H2,17,19).
What are the key properties of 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide?
2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide has a molecular weight of 312.80 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-chlorophenyl)methyl]-2-(methoxymethyl)morpholin-2-yl]acetamide is sourced from PubChem (CID 132776542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).