N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide

C10H17NO4 — CID 102567645

IUPACN-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide
SMILESCOC1C=CC(CCNC(C)=O)(OC)O1
InChIInChI=1S/C10H17NO4/c1-8(12)11-7-6-10(14-3)5-4-9(13-2)15-10/h4-5,9H,6-7H2,1-3H3,(H,11,12)
InChIKeyBMAPJSDZFKNPRO-UHFFFAOYSA-N
MW215.25 g/mol
LogP0.41
Rot. Bonds5

About N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide

N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide (PubChem CID 102567645) has the molecular formula C10H17NO4 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide
PubChem CID102567645
Molecular FormulaC10H17NO4
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC NameN-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide
SMILESCOC1C=CC(CCNC(C)=O)(OC)O1
InChIInChI=1S/C10H17NO4/c1-8(12)11-7-6-10(14-3)5-4-9(13-2)15-10/h4-5,9H,6-7H2,1-3H3,(H,11,12)
InChIKeyBMAPJSDZFKNPRO-UHFFFAOYSA-N
XLogP0.41
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_misc_A(5)', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2,5-dimethoxyoxolan-2-yl)ethyl]acetamide
CID 102567647
N-[2-[[(2R,5R)-2,5-dimethoxy-2H-furan-5-yl]methylsulfamoyl]ethyl]-3-methoxybenzamide
CID 7618105
N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide
CID 10888981
(1R)-1-[(2S,5S)-2,5-dimethoxy-2H-furan-5-yl]ethanol
CID 7167551
N-(3-acetamidopropyl)acetamide
CID 5147555
N-[2-[(3S)-3,4,5-trihydroxy-2-methyloxan-3-yl]ethyl]acetamide
CID 134582219
N-(2-acetamidoethyl)cyclopenta-2,4-diene-1-carboxamide
CID 102026166
1-methoxy-4-(1-methylcyclopentyl)benzene;N-[2-(1-methylcyclopentyl)ethyl]acetamide
CID 90755537
bis(2-acetamidoethyl)-dimethylazanium;methyl sulfate
CID 161461580
N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide;trihydrate
CID 70552532
N-[2-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]acetamide
CID 110790024
N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]acetamide
CID 18674787

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide?
The IUPAC name of N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide (CID 102567645) is N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide is COC1C=CC(CCNC(C)=O)(OC)O1.
What is the InChIKey of N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide?
The InChIKey is BMAPJSDZFKNPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO4/c1-8(12)11-7-6-10(14-3)5-4-9(13-2)15-10/h4-5,9H,6-7H2,1-3H3,(H,11,12).
What are the key properties of N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide?
N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide has a molecular weight of 215.25 g/mol, XLogP of 0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dimethoxy-2H-furan-5-yl)ethyl]acetamide is sourced from PubChem (CID 102567645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).