2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide

C14H18Cl2N2O3 — CID 36998178

IUPAC2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(COc1ccc(Cl)c(Cl)c1)NCCN1CCOCC1
InChIInChI=1S/C14H18Cl2N2O3/c15-12-2-1-11(9-13(12)16)21-10-14(19)17-3-4-18-5-7-20-8-6-18/h1-2,9H,3-8,10H2,(H,17,19)
InChIKeyQRLDSLIZKXOHLJ-UHFFFAOYSA-N
MW333.22 g/mol
LogP1.82
Rot. Bonds6

About 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide

2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 36998178) has the molecular formula C14H18Cl2N2O3 and a molecular weight of 333.22 g/mol. Its IUPAC name is 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID36998178
Molecular FormulaC14H18Cl2N2O3
Molecular Weight333.22 g/mol
Exact Mass332.07
IUPAC Name2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(COc1ccc(Cl)c(Cl)c1)NCCN1CCOCC1
InChIInChI=1S/C14H18Cl2N2O3/c15-12-2-1-11(9-13(12)16)21-10-14(19)17-3-4-18-5-7-20-8-6-18/h1-2,9H,3-8,10H2,(H,17,19)
InChIKeyQRLDSLIZKXOHLJ-UHFFFAOYSA-N
XLogP1.82
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.22
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide (CID 36998178) is 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide is O=C(COc1ccc(Cl)c(Cl)c1)NCCN1CCOCC1.
What is the InChIKey of 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is QRLDSLIZKXOHLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O3/c15-12-2-1-11(9-13(12)16)21-10-14(19)17-3-4-18-5-7-20-8-6-18/h1-2,9H,3-8,10H2,(H,17,19).
What are the key properties of 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 333.22 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 36998178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).