N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide

C18H22N2O5 — CID 113053908

IUPACN-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NCCN(Cc1ccco1)C(C)=O
InChIInChI=1S/C18H22N2O5/c1-14(21)20(12-15-6-5-11-24-15)10-9-19-18(22)13-25-17-8-4-3-7-16(17)23-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,19,22)
InChIKeyHIXBYVVHPNDUTD-UHFFFAOYSA-N
MW346.38 g/mol
LogP1.83
Rot. Bonds9

About N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide

N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 113053908) has the molecular formula C18H22N2O5 and a molecular weight of 346.38 g/mol. Its IUPAC name is N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide
PubChem CID113053908
Molecular FormulaC18H22N2O5
Molecular Weight346.38 g/mol
Exact Mass346.15
IUPAC NameN-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NCCN(Cc1ccco1)C(C)=O
InChIInChI=1S/C18H22N2O5/c1-14(21)20(12-15-6-5-11-24-15)10-9-19-18(22)13-25-17-8-4-3-7-16(17)23-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,19,22)
InChIKeyHIXBYVVHPNDUTD-UHFFFAOYSA-N
XLogP1.83
TPSA81.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.38
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[acetyl(3-methylbutyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide
CID 113056855
N-[2-[acetyl-[(3-methylphenyl)methyl]amino]ethyl]-2-(2-methoxyphenoxy)acetamide
CID 113054259
N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-fluorophenyl)acetamide
CID 113053913
N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(4-methylphenyl)acetamide
CID 113053917
N-[2-[acetyl(tert-butyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide
CID 113056601
N-[2-(N-acetyl-4-fluoroanilino)ethyl]-2-(2-methoxyphenoxy)acetamide
CID 113059329
N-(furan-2-ylmethyl)-2-(2-methoxyphenoxy)-N-phenylacetamide
CID 18100575
N-[2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]ethyl]-2-phenoxyacetamide
CID 113055840
N-[2-(N-acetyl-3,4-difluoroanilino)ethyl]-2-(2-methoxyphenoxy)acetamide
CID 113064642
N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 55527410
2-(2-ethoxyphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
CID 8961000
3-[acetyl-[(3,4-dimethoxyphenyl)methyl]amino]-N-(furan-2-ylmethyl)propanamide
CID 113122049

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide (CID 113053908) is N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)NCCN(Cc1ccco1)C(C)=O.
What is the InChIKey of N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is HIXBYVVHPNDUTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5/c1-14(21)20(12-15-6-5-11-24-15)10-9-19-18(22)13-25-17-8-4-3-7-16(17)23-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,19,22).
What are the key properties of N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide?
N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 346.38 g/mol, XLogP of 1.83, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 113053908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).