2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide

C11H18N2O3 — CID 43086708

IUPAC2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)NCc1ccco1
InChIInChI=1S/C11H18N2O3/c1-9(11(14)12-5-7-15-2)13-8-10-4-3-6-16-10/h3-4,6,9,13H,5,7-8H2,1-2H3,(H,12,14)
InChIKeyXKBSEUVZLDITDN-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.52
Rot. Bonds7

About 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide

2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide (PubChem CID 43086708) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide
PubChem CID43086708
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)NCc1ccco1
InChIInChI=1S/C11H18N2O3/c1-9(11(14)12-5-7-15-2)13-8-10-4-3-6-16-10/h3-4,6,9,13H,5,7-8H2,1-2H3,(H,12,14)
InChIKeyXKBSEUVZLDITDN-UHFFFAOYSA-N
XLogP0.52
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964
N-(furan-2-ylmethyl)-2-(methoxyamino)propanamide
CID 60702583
N-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]furan-2-carboxamide
CID 113218177
N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide
CID 62639953
2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 43466208
N-(furan-2-ylmethyl)-2-(3-propoxypropylamino)propanamide
CID 82943073
N-(furan-2-ylmethyl)-2-[(4-methylphenyl)methylamino]propanamide
CID 43084593
N-(furan-2-ylmethyl)-2-[(4-propan-2-yloxyphenyl)methylamino]propanamide
CID 119128983
2-(furan-2-ylmethylamino)-N-phenylpropanamide
CID 43083282
2-[(3-bromophenyl)methylamino]-N-(furan-2-ylmethyl)propanamide
CID 61401140
N-(2-methoxyethyl)-2-[(5-methylthiophen-2-yl)methylamino]propanamide
CID 62056243
N-(furan-2-ylmethyl)-2-(2-methoxyethylamino)acetamide
CID 3229603

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide (CID 43086708) is 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide is COCCNC(=O)C(C)NCc1ccco1.
What is the InChIKey of 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide?
The InChIKey is XKBSEUVZLDITDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c1-9(11(14)12-5-7-15-2)13-8-10-4-3-6-16-10/h3-4,6,9,13H,5,7-8H2,1-2H3,(H,12,14).
What are the key properties of 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide?
2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide has a molecular weight of 226.28 g/mol, XLogP of 0.52, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 43086708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).