2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid

C19H23NO5 — CID 120688153

IUPAC2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid
SMILESCCc1cc(C(=O)NCCc2ccc(OCC(=O)O)cc2)oc1CC
InChIInChI=1S/C19H23NO5/c1-3-14-11-17(25-16(14)4-2)19(23)20-10-9-13-5-7-15(8-6-13)24-12-18(21)22/h5-8,11H,3-4,9-10,12H2,1-2H3,(H,20,23)(H,21,22)
InChIKeySUVRSRAVKSJTGB-UHFFFAOYSA-N
MW345.40 g/mol
LogP2.84
Rot. Bonds9

About 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid

2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid (PubChem CID 120688153) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid.

Molecular Properties

Compound Name2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid
PubChem CID120688153
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC Name2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid
SMILESCCc1cc(C(=O)NCCc2ccc(OCC(=O)O)cc2)oc1CC
InChIInChI=1S/C19H23NO5/c1-3-14-11-17(25-16(14)4-2)19(23)20-10-9-13-5-7-15(8-6-13)24-12-18(21)22/h5-8,11H,3-4,9-10,12H2,1-2H3,(H,20,23)(H,21,22)
InChIKeySUVRSRAVKSJTGB-UHFFFAOYSA-N
XLogP2.84
TPSA88.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]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-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid
CID 119255862
2-[4-[2-[[5-(methylsulfamoyl)furan-2-carbonyl]amino]ethyl]phenoxy]acetic acid
CID 119255846
2-[4-[2-(methylamino)ethyl]phenoxy]acetic acid
CID 22961946
2-[4-[2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]ethyl]phenoxy]acetic acid
CID 120528979
2-[4-[2-(2,3-dimethylpentanoylamino)ethyl]phenoxy]acetic acid
CID 120529051
4-[2-[(5-ethyl-4-methylfuran-2-carbonyl)amino]ethyl]benzoic acid
CID 120512985
2-[4-[2-(3-methoxypropanoylamino)ethyl]phenoxy]acetic acid
CID 119255509
2-[4-[2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]ethyl]phenoxy]acetic acid
CID 119255955
2-[4-[2-[[2-(methoxymethyl)benzoyl]amino]ethyl]phenoxy]acetic acid
CID 119255595
2-[4-[2-(3-ethylpentanoylamino)ethyl]phenoxy]acetic acid
CID 120529071
2-[4-[2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)ethyl]phenoxy]acetic acid
CID 119255550
2-[4-[2-[(1,5-dimethylpyrazole-3-carbonyl)amino]ethyl]phenoxy]acetic acid
CID 119255833

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid?
The IUPAC name of 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid (CID 120688153) is 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid.
What is the SMILES notation for 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid?
The canonical SMILES for 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid is CCc1cc(C(=O)NCCc2ccc(OCC(=O)O)cc2)oc1CC.
What is the InChIKey of 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid?
The InChIKey is SUVRSRAVKSJTGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-3-14-11-17(25-16(14)4-2)19(23)20-10-9-13-5-7-15(8-6-13)24-12-18(21)22/h5-8,11H,3-4,9-10,12H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid?
2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid has a molecular weight of 345.40 g/mol, XLogP of 2.84, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[(4,5-diethylfuran-2-carbonyl)amino]ethyl]phenoxy]acetic acid is sourced from PubChem (CID 120688153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).