2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid

C15H20N2O4 — CID 80549799

IUPAC2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
SMILESCC(C)(C(=O)O)c1ccc(NC(=O)C2CNCCO2)cc1
InChIInChI=1S/C15H20N2O4/c1-15(2,14(19)20)10-3-5-11(6-4-10)17-13(18)12-9-16-7-8-21-12/h3-6,12,16H,7-9H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyLZFREMPAPLJWGY-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.98
Rot. Bonds4

About 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid

2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid (PubChem CID 80549799) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid.

Molecular Properties

Compound Name2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
PubChem CID80549799
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
SMILESCC(C)(C(=O)O)c1ccc(NC(=O)C2CNCCO2)cc1
InChIInChI=1S/C15H20N2O4/c1-15(2,14(19)20)10-3-5-11(6-4-10)17-13(18)12-9-16-7-8-21-12/h3-6,12,16H,7-9H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyLZFREMPAPLJWGY-UHFFFAOYSA-N
XLogP0.98
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic 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

N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119700164
3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 115340051
N-[4-(propylcarbamoyl)phenyl]morpholine-2-carboxamide
CID 119739016
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide
CID 119794533
N-[4-[3-(dimethylamino)propanoylamino]phenyl]morpholine-2-carboxamide;dihydrochloride
CID 119868290
N-(4-pentylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119686937
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119794532
N-(6-fluoro-3-pyridinyl)morpholine-2-carboxamide
CID 103808720
N-(6-bromo-3-pyridinyl)morpholine-2-carboxamide
CID 103813958
N-[4-(prop-2-enylcarbamoyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119740967
N-[4-(2,2,2-trifluoroethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119698644

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid?
The IUPAC name of 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid (CID 80549799) is 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid.
What is the SMILES notation for 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid?
The canonical SMILES for 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid is CC(C)(C(=O)O)c1ccc(NC(=O)C2CNCCO2)cc1.
What is the InChIKey of 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid?
The InChIKey is LZFREMPAPLJWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-15(2,14(19)20)10-3-5-11(6-4-10)17-13(18)12-9-16-7-8-21-12/h3-6,12,16H,7-9H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid?
2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid has a molecular weight of 292.33 g/mol, XLogP of 0.98, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid is sourced from PubChem (CID 80549799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).