N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide

C15H17NO4 — CID 46400217

IUPACN-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide
SMILESCOc1cccc(OCCNC(=O)c2ccoc2C)c1
InChIInChI=1S/C15H17NO4/c1-11-14(6-8-19-11)15(17)16-7-9-20-13-5-3-4-12(10-13)18-2/h3-6,8,10H,7,9H2,1-2H3,(H,16,17)
InChIKeyVNROWYRQTGXOCH-UHFFFAOYSA-N
MW275.30 g/mol
LogP2.41
Rot. Bonds6

About N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide

N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide (PubChem CID 46400217) has the molecular formula C15H17NO4 and a molecular weight of 275.30 g/mol. Its IUPAC name is N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide
PubChem CID46400217
Molecular FormulaC15H17NO4
Molecular Weight275.30 g/mol
Exact Mass275.12
IUPAC NameN-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide
SMILESCOc1cccc(OCCNC(=O)c2ccoc2C)c1
InChIInChI=1S/C15H17NO4/c1-11-14(6-8-19-11)15(17)16-7-9-20-13-5-3-4-12(10-13)18-2/h3-6,8,10H,7,9H2,1-2H3,(H,16,17)
InChIKeyVNROWYRQTGXOCH-UHFFFAOYSA-N
XLogP2.41
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 52.41
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-[2-(4-chlorophenoxy)ethyl]-2-methylfuran-3-carboxamide
CID 33183396
N-[2-(3-methoxyphenoxy)ethyl]-3,4-dimethylbenzamide
CID 94051659
2-ethyl-N-[2-(3-methoxyphenoxy)ethyl]butanamide
CID 113099794
[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl] 2-methylfuran-3-carboxylate
CID 8970024
N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methoxyphenyl)acetamide
CID 46399940
2-(2,6-dichlorophenyl)-N-[2-(3-methoxyphenoxy)ethyl]acetamide
CID 46449388
N-[2-(3-ethoxyphenoxy)ethyl]-3,5-dimethoxybenzamide
CID 113100586
2,4-dimethoxy-N-[3-(3-methylphenoxy)propyl]benzamide
CID 27039874
2-chloro-4,5-dimethoxy-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 86574521
N-[2-(3-bromophenoxy)ethyl]-3,5-dimethoxybenzamide
CID 113099639
3-methoxy-N-[2-(4-methylphenoxy)ethyl]benzamide
CID 7761263
N-[2-(3-methoxyphenoxy)ethyl]-3,5-dinitrobenzamide
CID 580265

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide?
The IUPAC name of N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide (CID 46400217) is N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide is COc1cccc(OCCNC(=O)c2ccoc2C)c1.
What is the InChIKey of N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide?
The InChIKey is VNROWYRQTGXOCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4/c1-11-14(6-8-19-11)15(17)16-7-9-20-13-5-3-4-12(10-13)18-2/h3-6,8,10H,7,9H2,1-2H3,(H,16,17).
What are the key properties of N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide?
N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide has a molecular weight of 275.30 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenoxy)ethyl]-2-methylfuran-3-carboxamide is sourced from PubChem (CID 46400217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).