2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid

C10H18N2O4 — CID 43544964

IUPAC2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid
SMILESCC1CN(C(=O)N(C)CC(=O)O)C(C)CO1
InChIInChI=1S/C10H18N2O4/c1-7-6-16-8(2)4-12(7)10(15)11(3)5-9(13)14/h7-8H,4-6H2,1-3H3,(H,13,14)
InChIKeyNHWOINHFGAOADC-UHFFFAOYSA-N
MW230.26 g/mol
LogP0.23
Rot. Bonds2

About 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid

2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid (PubChem CID 43544964) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid.

Molecular Properties

Compound Name2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid
PubChem CID43544964
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid
SMILESCC1CN(C(=O)N(C)CC(=O)O)C(C)CO1
InChIInChI=1S/C10H18N2O4/c1-7-6-16-8(2)4-12(7)10(15)11(3)5-9(13)14/h7-8H,4-6H2,1-3H3,(H,13,14)
InChIKeyNHWOINHFGAOADC-UHFFFAOYSA-N
XLogP0.23
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid?
The IUPAC name of 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid (CID 43544964) is 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid.
What is the SMILES notation for 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid?
The canonical SMILES for 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid is CC1CN(C(=O)N(C)CC(=O)O)C(C)CO1.
What is the InChIKey of 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid?
The InChIKey is NHWOINHFGAOADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-7-6-16-8(2)4-12(7)10(15)11(3)5-9(13)14/h7-8H,4-6H2,1-3H3,(H,13,14).
What are the key properties of 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid?
2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid has a molecular weight of 230.26 g/mol, XLogP of 0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]acetic acid is sourced from PubChem (CID 43544964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).