3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide

C15H22N2O4 — CID 106112484

IUPAC3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide
SMILESCCOc1cc2c(cc1NC(=O)C(CN)OC)OC(C)C2
InChIInChI=1S/C15H22N2O4/c1-4-20-13-6-10-5-9(2)21-12(10)7-11(13)17-15(18)14(8-16)19-3/h6-7,9,14H,4-5,8,16H2,1-3H3,(H,17,18)
InChIKeyRDRSQHLIIIUVRU-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.32
Rot. Bonds6

About 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide

3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide (PubChem CID 106112484) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide.

Molecular Properties

Compound Name3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide
PubChem CID106112484
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide
SMILESCCOc1cc2c(cc1NC(=O)C(CN)OC)OC(C)C2
InChIInChI=1S/C15H22N2O4/c1-4-20-13-6-10-5-9(2)21-12(10)7-11(13)17-15(18)14(8-16)19-3/h6-7,9,14H,4-5,8,16H2,1-3H3,(H,17,18)
InChIKeyRDRSQHLIIIUVRU-UHFFFAOYSA-N
XLogP1.32
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide 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

(2R)-2-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-3-methylbutanamide
CID 79011910
N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119697410
N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methyl-3-(methylamino)propanamide
CID 79203858
1-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-3-(4-hydroxycyclohexyl)urea
CID 95155893
3-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)carbamoylamino]propanoic acid
CID 122075038
4-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)benzamide
CID 119697390
3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)benzamide;hydrochloride
CID 119697413
(2S,5R)-5-(aminomethyl)-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)oxolane-2-carboxamide
CID 120785022
3-(2-aminophenyl)-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)propanamide;hydrochloride
CID 120608429
5-chloro-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)pentanamide
CID 43347022
N-(2-bromo-4-methylphenyl)-2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)amino]propanamide
CID 42926535
2-(2,3-dichlorophenoxy)-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)propanamide
CID 43078029

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide?
The IUPAC name of 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide (CID 106112484) is 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide.
What is the SMILES notation for 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide?
The canonical SMILES for 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide is CCOc1cc2c(cc1NC(=O)C(CN)OC)OC(C)C2.
What is the InChIKey of 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide?
The InChIKey is RDRSQHLIIIUVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-4-20-13-6-10-5-9(2)21-12(10)7-11(13)17-15(18)14(8-16)19-3/h6-7,9,14H,4-5,8,16H2,1-3H3,(H,17,18).
What are the key properties of 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide?
3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide has a molecular weight of 294.35 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-methoxypropanamide is sourced from PubChem (CID 106112484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).