2-[2-(aminomethyl)morpholin-4-yl]acetic acid

C7H14N2O3 — CID 112703856

IUPAC2-[2-(aminomethyl)morpholin-4-yl]acetic acid
SMILESNCC1CN(CC(=O)O)CCO1
InChIInChI=1S/C7H14N2O3/c8-3-6-4-9(1-2-12-6)5-7(10)11/h6H,1-5,8H2,(H,10,11)
InChIKeyHSDBZHQYXZNARO-UHFFFAOYSA-N
MW174.20 g/mol
LogP-1.27
Rot. Bonds3

About 2-[2-(aminomethyl)morpholin-4-yl]acetic acid

2-[2-(aminomethyl)morpholin-4-yl]acetic acid (PubChem CID 112703856) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-[2-(aminomethyl)morpholin-4-yl]acetic acid.

Molecular Properties

Compound Name2-[2-(aminomethyl)morpholin-4-yl]acetic acid
PubChem CID112703856
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Name2-[2-(aminomethyl)morpholin-4-yl]acetic acid
SMILESNCC1CN(CC(=O)O)CCO1
InChIInChI=1S/C7H14N2O3/c8-3-6-4-9(1-2-12-6)5-7(10)11/h6H,1-5,8H2,(H,10,11)
InChIKeyHSDBZHQYXZNARO-UHFFFAOYSA-N
XLogP-1.27
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-1.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]acetic acid?
The IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]acetic acid (CID 112703856) is 2-[2-(aminomethyl)morpholin-4-yl]acetic acid.
What is the SMILES notation for 2-[2-(aminomethyl)morpholin-4-yl]acetic acid?
The canonical SMILES for 2-[2-(aminomethyl)morpholin-4-yl]acetic acid is NCC1CN(CC(=O)O)CCO1.
What is the InChIKey of 2-[2-(aminomethyl)morpholin-4-yl]acetic acid?
The InChIKey is HSDBZHQYXZNARO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3/c8-3-6-4-9(1-2-12-6)5-7(10)11/h6H,1-5,8H2,(H,10,11).
What are the key properties of 2-[2-(aminomethyl)morpholin-4-yl]acetic acid?
2-[2-(aminomethyl)morpholin-4-yl]acetic acid has a molecular weight of 174.20 g/mol, XLogP of -1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)morpholin-4-yl]acetic acid is sourced from PubChem (CID 112703856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).