2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid

C14H18N2O5 — CID 2813227

IUPAC2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid
SMILESO=C(O)COCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C14H18N2O5/c17-13(9-21-10-14(18)19)15-11-3-1-2-4-12(11)16-5-7-20-8-6-16/h1-4H,5-10H2,(H,15,17)(H,18,19)
InChIKeyKWOWENQOBWHJEC-UHFFFAOYSA-N
MW294.31 g/mol
LogP0.56
Rot. Bonds6

About 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid

2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid (PubChem CID 2813227) has the molecular formula C14H18N2O5 and a molecular weight of 294.31 g/mol. Its IUPAC name is 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid.

Molecular Properties

Compound Name2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid
PubChem CID2813227
Molecular FormulaC14H18N2O5
Molecular Weight294.31 g/mol
Exact Mass294.12
IUPAC Name2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid
SMILESO=C(O)COCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C14H18N2O5/c17-13(9-21-10-14(18)19)15-11-3-1-2-4-12(11)16-5-7-20-8-6-16/h1-4H,5-10H2,(H,15,17)(H,18,19)
InChIKeyKWOWENQOBWHJEC-UHFFFAOYSA-N
XLogP0.56
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid?
The IUPAC name of 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid (CID 2813227) is 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid.
What is the SMILES notation for 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid?
The canonical SMILES for 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid is O=C(O)COCC(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid?
The InChIKey is KWOWENQOBWHJEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O5/c17-13(9-21-10-14(18)19)15-11-3-1-2-4-12(11)16-5-7-20-8-6-16/h1-4H,5-10H2,(H,15,17)(H,18,19).
What are the key properties of 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid?
2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid has a molecular weight of 294.31 g/mol, XLogP of 0.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-morpholin-4-ylanilino)-2-oxoethoxy]acetic acid is sourced from PubChem (CID 2813227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).