N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide

C17H21NO4 — CID 53286312

IUPACN-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide
SMILESCOc1ccccc1OC(C)C(=O)NCCCc1ccco1
InChIInChI=1S/C17H21NO4/c1-13(22-16-10-4-3-9-15(16)20-2)17(19)18-11-5-7-14-8-6-12-21-14/h3-4,6,8-10,12-13H,5,7,11H2,1-2H3,(H,18,19)
InChIKeyHGDUNWNWKASFGK-UHFFFAOYSA-N
MW303.36 g/mol
LogP2.80
Rot. Bonds8

About N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide

N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide (PubChem CID 53286312) has the molecular formula C17H21NO4 and a molecular weight of 303.36 g/mol. Its IUPAC name is N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide
PubChem CID53286312
Molecular FormulaC17H21NO4
Molecular Weight303.36 g/mol
Exact Mass303.15
IUPAC NameN-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide
SMILESCOc1ccccc1OC(C)C(=O)NCCCc1ccco1
InChIInChI=1S/C17H21NO4/c1-13(22-16-10-4-3-9-15(16)20-2)17(19)18-11-5-7-14-8-6-12-21-14/h3-4,6,8-10,12-13H,5,7,11H2,1-2H3,(H,18,19)
InChIKeyHGDUNWNWKASFGK-UHFFFAOYSA-N
XLogP2.80
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(furan-2-yl)propyl]-2-(2-methylphenoxy)propanamide
CID 53283656
(2R)-N-butyl-2-(2-methoxyphenoxy)propanamide
CID 40745436
2-(2-methoxyphenoxy)-N-[3-(3-propan-2-yloxyphenyl)propyl]propanamide
CID 132655789
2-(2-chlorophenoxy)-N-[3-(furan-2-ylmethoxy)propyl]propanamide
CID 86925216
(2S)-N-[3-(2-methoxyphenyl)propyl]-2-(2-methylphenoxy)propanamide
CID 92685168
2-(2-bromophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 17173386
2-(2-fluorophenoxy)-N-[3-(furan-2-yl)propyl]butanamide
CID 53286413
(2S)-2-(2-acetamidophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 9116644
N-(3-imidazol-1-ylpropyl)-2-(2-methoxyphenoxy)propanamide
CID 17200482
(2R)-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-(2-methylphenoxy)propanamide
CID 99954558
2-(2-aminophenoxy)-N-(3-methoxypropyl)propanamide
CID 60747305
N-(furan-2-ylmethyl)-2-(2-nitrophenoxy)propanamide
CID 4943832

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide?
The IUPAC name of N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide (CID 53286312) is N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide.
What is the SMILES notation for N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide?
The canonical SMILES for N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide is COc1ccccc1OC(C)C(=O)NCCCc1ccco1.
What is the InChIKey of N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide?
The InChIKey is HGDUNWNWKASFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO4/c1-13(22-16-10-4-3-9-15(16)20-2)17(19)18-11-5-7-14-8-6-12-21-14/h3-4,6,8-10,12-13H,5,7,11H2,1-2H3,(H,18,19).
What are the key properties of N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide?
N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide has a molecular weight of 303.36 g/mol, XLogP of 2.80, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)propyl]-2-(2-methoxyphenoxy)propanamide is sourced from PubChem (CID 53286312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).