2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid

C15H21NO5 — CID 120687888

IUPAC2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid
SMILESCCc1cc(C(=O)N2CCOC(CC(=O)O)C2)oc1CC
InChIInChI=1S/C15H21NO5/c1-3-10-7-13(21-12(10)4-2)15(19)16-5-6-20-11(9-16)8-14(17)18/h7,11H,3-6,8-9H2,1-2H3,(H,17,18)
InChIKeyQVOYSFCTKSQJIR-UHFFFAOYSA-N
MW295.34 g/mol
LogP1.72
Rot. Bonds5

About 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid

2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid (PubChem CID 120687888) has the molecular formula C15H21NO5 and a molecular weight of 295.34 g/mol. Its IUPAC name is 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid
PubChem CID120687888
Molecular FormulaC15H21NO5
Molecular Weight295.34 g/mol
Exact Mass295.14
IUPAC Name2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid
SMILESCCc1cc(C(=O)N2CCOC(CC(=O)O)C2)oc1CC
InChIInChI=1S/C15H21NO5/c1-3-10-7-13(21-12(10)4-2)15(19)16-5-6-20-11(9-16)8-14(17)18/h7,11H,3-6,8-9H2,1-2H3,(H,17,18)
InChIKeyQVOYSFCTKSQJIR-UHFFFAOYSA-N
XLogP1.72
TPSA79.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-(4,5-diethylfuran-2-carbonyl)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-[4-[2-(4-ethylphenyl)acetyl]morpholin-2-yl]acetic acid
CID 119248876
2-[4-(5-bromo-1-benzofuran-2-carbonyl)morpholin-2-yl]acetic acid
CID 119247587
2-[4-(5-chloro-1-benzofuran-2-carbonyl)morpholin-2-yl]acetic acid
CID 119247536
2-[4-(5-ethylthiophene-2-carbonyl)morpholin-2-yl]acetic acid
CID 66421949
2-[4-(3,4-dimethylbenzoyl)morpholin-2-yl]acetic acid
CID 66433602
2-[4-(3-ethyl-6-methylpyridazine-4-carbonyl)morpholin-2-yl]acetic acid
CID 104669797
2-[(2R)-4-(2,5-difluoro-4-methylbenzoyl)morpholin-2-yl]acetic acid
CID 124695384
2-[4-(3-ethyl-1-methylpyrazole-4-carbonyl)morpholin-2-yl]acetic acid
CID 102810250
2-[4-(3-ethoxybenzoyl)morpholin-2-yl]acetic acid
CID 119248791
2-[(2S)-4-(4-bromo-1-ethylpyrrole-2-carbonyl)morpholin-2-yl]acetic acid
CID 124515313
2-[4-(2,5-dihydroxybenzoyl)morpholin-2-yl]acetic acid
CID 107721729
2-[4-(3-iodo-4-methylbenzoyl)morpholin-2-yl]acetic acid
CID 119247963

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid (CID 120687888) is 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid is CCc1cc(C(=O)N2CCOC(CC(=O)O)C2)oc1CC.
What is the InChIKey of 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid?
The InChIKey is QVOYSFCTKSQJIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO5/c1-3-10-7-13(21-12(10)4-2)15(19)16-5-6-20-11(9-16)8-14(17)18/h7,11H,3-6,8-9H2,1-2H3,(H,17,18).
What are the key properties of 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid?
2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid has a molecular weight of 295.34 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4,5-diethylfuran-2-carbonyl)morpholin-2-yl]acetic acid is sourced from PubChem (CID 120687888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).