2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide

C14H14N2O4 — CID 79794769

IUPAC2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide
SMILESCC(Oc1ccc(C=O)nc1)C(=O)NCc1ccco1
InChIInChI=1S/C14H14N2O4/c1-10(14(18)16-7-12-3-2-6-19-12)20-13-5-4-11(9-17)15-8-13/h2-6,8-10H,7H2,1H3,(H,16,18)
InChIKeyHIDGAWXPUMCQPY-UHFFFAOYSA-N
MW274.28 g/mol
LogP1.57
Rot. Bonds6

About 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide

2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide (PubChem CID 79794769) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide
PubChem CID79794769
Molecular FormulaC14H14N2O4
Molecular Weight274.28 g/mol
Exact Mass274.10
IUPAC Name2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide
SMILESCC(Oc1ccc(C=O)nc1)C(=O)NCc1ccco1
InChIInChI=1S/C14H14N2O4/c1-10(14(18)16-7-12-3-2-6-19-12)20-13-5-4-11(9-17)15-8-13/h2-6,8-10H,7H2,1H3,(H,16,18)
InChIKeyHIDGAWXPUMCQPY-UHFFFAOYSA-N
XLogP1.57
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-(4-fluorophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 26909573
N-(furan-2-ylmethyl)-2-[4-(1-hydroxyethyl)phenoxy]propanamide
CID 43503670
(2R)-2-(4-tert-butylphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 973402
N-(furan-2-ylmethyl)-2-(3-methoxyphenoxy)propanamide
CID 19203901
(2S)-2-[4-(4-fluorobenzoyl)phenoxy]-N-(furan-2-ylmethyl)propanamide
CID 7382374
2-(4-chloro-3,5-dimethylphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 19191627
(2S)-2-[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]oxypropanoic acid
CID 104876319
[(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 5-methylpyrazine-2-carboxylate
CID 7760510
2-(2-bromo-4-methoxyphenoxy)-N-(furan-2-ylmethyl)propanamide
CID 104707302
2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 17173386
N-(furan-2-ylmethyl)-2-quinolin-8-yloxypropanamide
CID 4781245
(2S)-2-(2-acetamidophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 9116644

Frequently Asked Questions

What is the IUPAC name of 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide (CID 79794769) is 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide is CC(Oc1ccc(C=O)nc1)C(=O)NCc1ccco1.
What is the InChIKey of 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is HIDGAWXPUMCQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4/c1-10(14(18)16-7-12-3-2-6-19-12)20-13-5-4-11(9-17)15-8-13/h2-6,8-10H,7H2,1H3,(H,16,18).
What are the key properties of 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide?
2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide has a molecular weight of 274.28 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-formyl-3-pyridinyl)oxy]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 79794769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).