2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide

C10H13N3O3 — CID 106235935

IUPAC2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide
SMILESN#Cc1ccc(CNCCOCC(N)=O)o1
InChIInChI=1S/C10H13N3O3/c11-5-8-1-2-9(16-8)6-13-3-4-15-7-10(12)14/h1-2,13H,3-4,6-7H2,(H2,12,14)
InChIKeyABQVHMSYWWNVIO-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.26
Rot. Bonds7

About 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide

2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide (PubChem CID 106235935) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide
PubChem CID106235935
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide
SMILESN#Cc1ccc(CNCCOCC(N)=O)o1
InChIInChI=1S/C10H13N3O3/c11-5-8-1-2-9(16-8)6-13-3-4-15-7-10(12)14/h1-2,13H,3-4,6-7H2,(H2,12,14)
InChIKeyABQVHMSYWWNVIO-UHFFFAOYSA-N
XLogP-0.26
TPSA101.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[(2-methoxyethylamino)methyl]furan-2-carbonitrile
CID 115651300
5-[(3-hydroxypropylamino)methyl]furan-2-carbonitrile
CID 115651259
5-[[3-(2-methylpropoxy)propylamino]methyl]furan-2-carbonitrile
CID 115651717
2-[2-[(4-cyano-2,6-difluorophenyl)methylamino]ethoxy]acetamide
CID 106235036
N-[(5-ethylfuran-2-yl)methyl]-2-(2-methylprop-2-enoxy)ethanamine
CID 115699316
5-[(4-cyanobutylamino)methyl]furan-2-carbonitrile
CID 115653264
5-[[2-(2-amino-2-oxoethoxy)ethylamino]methyl]-1,2-oxazole-3-carboxylic acid
CID 106238420
5-[(cyclooctylmethylamino)methyl]furan-2-carbonitrile
CID 119138452
5-[[(3-hydroxy-4-methylpentyl)amino]methyl]furan-2-carbonitrile
CID 115654714
5-[[(2-hydroxy-2-methylpropyl)amino]methyl]furan-2-carbonitrile
CID 115653697
5-[[2-[ethyl(methyl)amino]ethylamino]methyl]furan-2-carbonitrile
CID 115652842
2-[[2-(2-amino-2-oxoethoxy)ethylamino]methyl]furan-3-carboxylic acid
CID 106238447

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide (CID 106235935) is 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide is N#Cc1ccc(CNCCOCC(N)=O)o1.
What is the InChIKey of 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide?
The InChIKey is ABQVHMSYWWNVIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c11-5-8-1-2-9(16-8)6-13-3-4-15-7-10(12)14/h1-2,13H,3-4,6-7H2,(H2,12,14).
What are the key properties of 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide?
2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide has a molecular weight of 223.23 g/mol, XLogP of -0.26, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(5-cyanofuran-2-yl)methylamino]ethoxy]acetamide is sourced from PubChem (CID 106235935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).