2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid

C11H19NO4 — CID 66420375

IUPAC2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid
SMILESCC(C)(C)C(=O)N1CCOC(CC(=O)O)C1
InChIInChI=1S/C11H19NO4/c1-11(2,3)10(15)12-4-5-16-8(7-12)6-9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
InChIKeyKCFJDPGMJYFDPT-UHFFFAOYSA-N
MW229.28 g/mol
LogP0.73
Rot. Bonds2

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

2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid (PubChem CID 66420375) has the molecular formula C11H19NO4 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid
PubChem CID66420375
Molecular FormulaC11H19NO4
Molecular Weight229.28 g/mol
Exact Mass229.13
IUPAC Name2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid
SMILESCC(C)(C)C(=O)N1CCOC(CC(=O)O)C1
InChIInChI=1S/C11H19NO4/c1-11(2,3)10(15)12-4-5-16-8(7-12)6-9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
InChIKeyKCFJDPGMJYFDPT-UHFFFAOYSA-N
XLogP0.73
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2S)-4-(2,2-dimethylbutanoyl)morpholin-2-yl]acetic acid
CID 124515405
1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one
CID 166684101
2-[4-(2-amino-2-ethylbutanoyl)morpholin-2-yl]acetic acid
CID 79813878
2-[4-(2,2,4-trimethylpentanoyl)morpholin-2-yl]acetic acid
CID 120687874
1-[2-(bromomethyl)morpholin-4-yl]-2,2-dimethylpropan-1-one
CID 81211878
2-[4-[2-methyl-2-(2-methylphenyl)propanoyl]morpholin-2-yl]acetic acid
CID 119248442
2-[4-(3,3-dimethylbutan-2-ylcarbamoyl)morpholin-2-yl]acetic acid
CID 104829302
2-[4-(2-methyl-2-piperidin-3-ylpropanoyl)morpholin-2-yl]acetic acid
CID 83200057
2-[4-[(2S)-2-aminopropanoyl]morpholin-2-yl]acetic acid
CID 66433437
2-[4-(diethylcarbamoyl)morpholin-2-yl]acetic acid
CID 66435597
4-(2,2-dimethylpropanoyl)morpholine-2-carboxylic acid
CID 54595495
2-[4-[2-(4-ethylphenyl)acetyl]morpholin-2-yl]acetic acid
CID 119248876

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid (CID 66420375) is 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid is CC(C)(C)C(=O)N1CCOC(CC(=O)O)C1.
What is the InChIKey of 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid?
The InChIKey is KCFJDPGMJYFDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO4/c1-11(2,3)10(15)12-4-5-16-8(7-12)6-9(13)14/h8H,4-7H2,1-3H3,(H,13,14).
What are the key properties of 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid?
2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid has a molecular weight of 229.28 g/mol, XLogP of 0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid is sourced from PubChem (CID 66420375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).