2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid

C8H16N2O3 — CID 123985697

IUPAC2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid
SMILESCNN1CCOC(C)C1CC(=O)O
InChIInChI=1S/C8H16N2O3/c1-6-7(5-8(11)12)10(9-2)3-4-13-6/h6-7,9H,3-5H2,1-2H3,(H,11,12)
InChIKeyWZOODHKSKIZWMU-UHFFFAOYSA-N
MW188.23 g/mol
LogP-0.32
Rot. Bonds3

About 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid

2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid (PubChem CID 123985697) has the molecular formula C8H16N2O3 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid
PubChem CID123985697
Molecular FormulaC8H16N2O3
Molecular Weight188.23 g/mol
Exact Mass188.12
IUPAC Name2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid
SMILESCNN1CCOC(C)C1CC(=O)O
InChIInChI=1S/C8H16N2O3/c1-6-7(5-8(11)12)10(9-2)3-4-13-6/h6-7,9H,3-5H2,1-2H3,(H,11,12)
InChIKeyWZOODHKSKIZWMU-UHFFFAOYSA-N
XLogP-0.32
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-Methylmorpholin-3-yl)acetic acid
CID 82275223
Methyl 2-[4-(dimethylamino)-2-methylmorpholin-3-yl]acetate
CID 123175869
Methyl 2-[2-methyl-4-(propan-2-ylamino)morpholin-3-yl]acetate
CID 123425553
Methyl 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetate
CID 123814538
Methyl 2-[4-methyl-4-(methylamino)morpholin-4-ium-3-yl]acetate
CID 123940602
2-[4-(Methylamino)morpholin-3-yl]acetic acid
CID 132229152
3-[(2S)-4-(methylamino)morpholin-2-yl]propanoic acid
CID 154028639
3-(Morpholin-4-ylamino)butanoic acid
CID 83022249
2-(Morpholin-4-ylamino)pentanoic acid
CID 83041870

Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid?
The IUPAC name of 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid (CID 123985697) is 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid.
What is the SMILES notation for 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid?
The canonical SMILES for 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid is CNN1CCOC(C)C1CC(=O)O.
What is the InChIKey of 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid?
The InChIKey is WZOODHKSKIZWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3/c1-6-7(5-8(11)12)10(9-2)3-4-13-6/h6-7,9H,3-5H2,1-2H3,(H,11,12).
What are the key properties of 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid?
2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid has a molecular weight of 188.23 g/mol, XLogP of -0.32, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-4-(methylamino)morpholin-3-yl]acetic acid is sourced from PubChem (CID 123985697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).