2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid

C14H19N3O3 — CID 117444231

IUPAC2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid
SMILESCC(C)N1CCN(c2cccc(C(N)C(=O)O)c2)C1=O
InChIInChI=1S/C14H19N3O3/c1-9(2)16-6-7-17(14(16)20)11-5-3-4-10(8-11)12(15)13(18)19/h3-5,8-9,12H,6-7,15H2,1-2H3,(H,18,19)
InChIKeyMZTVWKKCCHRXGW-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.42
Rot. Bonds4

About 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid

2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid (PubChem CID 117444231) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid.

Molecular Properties

Compound Name2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid
PubChem CID117444231
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid
SMILESCC(C)N1CCN(c2cccc(C(N)C(=O)O)c2)C1=O
InChIInChI=1S/C14H19N3O3/c1-9(2)16-6-7-17(14(16)20)11-5-3-4-10(8-11)12(15)13(18)19/h3-5,8-9,12H,6-7,15H2,1-2H3,(H,18,19)
InChIKeyMZTVWKKCCHRXGW-UHFFFAOYSA-N
XLogP1.42
TPSA86.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]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

1-[3-(1-aminoethyl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117371582
methyl 2-hydroxy-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetate
CID 117472059
3-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]butanal
CID 117438638
1-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]cyclobutane-1-carboxylic acid
CID 117487167
4-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]butanoic acid
CID 117469221
3-amino-3-[3-(3-methyl-2-oxoimidazolidin-1-yl)phenyl]propanoic acid
CID 117412461
2-amino-2-[3-(3-methyl-2-oxoimidazol-1-yl)phenyl]acetic acid
CID 117369952
2-amino-2-[3-[3-[3-methyl-4-[4-(1-methyl-5-oxo-1,2,4-triazol-4-yl)phenyl]-2-pyridinyl]-2-oxoimidazolidin-1-yl]phenyl]acetic acid
CID 178108897
2-amino-2-(3-methylphenyl)acetic acid;hydrochloride
CID 24730259
1-propan-2-yl-3-(3-pyrrolidin-2-ylphenyl)imidazolidin-2-one
CID 117436394
1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117410772
1-(3-butan-2-ylphenyl)-3-methylimidazolidin-2-one
CID 126760369

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid?
The IUPAC name of 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid (CID 117444231) is 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid.
What is the SMILES notation for 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid?
The canonical SMILES for 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid is CC(C)N1CCN(c2cccc(C(N)C(=O)O)c2)C1=O.
What is the InChIKey of 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid?
The InChIKey is MZTVWKKCCHRXGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-9(2)16-6-7-17(14(16)20)11-5-3-4-10(8-11)12(15)13(18)19/h3-5,8-9,12H,6-7,15H2,1-2H3,(H,18,19).
What are the key properties of 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid?
2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid has a molecular weight of 277.32 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid is sourced from PubChem (CID 117444231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).