2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide

C18H25ClN2O4 — CID 55602811

IUPAC2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1)NCC(C1CCOC1)N1CCOCC1
InChIInChI=1S/C18H25ClN2O4/c19-15-1-3-16(4-2-15)25-13-18(22)20-11-17(14-5-8-24-12-14)21-6-9-23-10-7-21/h1-4,14,17H,5-13H2,(H,20,22)
InChIKeyBKCLRCAHHNEWBZ-UHFFFAOYSA-N
MW368.86 g/mol
LogP1.57
Rot. Bonds7

About 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide

2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide (PubChem CID 55602811) has the molecular formula C18H25ClN2O4 and a molecular weight of 368.86 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide
PubChem CID55602811
Molecular FormulaC18H25ClN2O4
Molecular Weight368.86 g/mol
Exact Mass368.15
IUPAC Name2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1)NCC(C1CCOC1)N1CCOCC1
InChIInChI=1S/C18H25ClN2O4/c19-15-1-3-16(4-2-15)25-13-18(22)20-11-17(14-5-8-24-12-14)21-6-9-23-10-7-21/h1-4,14,17H,5-13H2,(H,20,22)
InChIKeyBKCLRCAHHNEWBZ-UHFFFAOYSA-N
XLogP1.57
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.86
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide (CID 55602811) is 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide is O=C(COc1ccc(Cl)cc1)NCC(C1CCOC1)N1CCOCC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide?
The InChIKey is BKCLRCAHHNEWBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN2O4/c19-15-1-3-16(4-2-15)25-13-18(22)20-11-17(14-5-8-24-12-14)21-6-9-23-10-7-21/h1-4,14,17H,5-13H2,(H,20,22).
What are the key properties of 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide?
2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide has a molecular weight of 368.86 g/mol, XLogP of 1.57, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]acetamide is sourced from PubChem (CID 55602811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).