N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide

C23H25NO4 — CID 55806853

IUPACN-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1cccc(OCC(=O)Nc2cccc(COCc3ccco3)c2)c1
InChIInChI=1S/C23H25NO4/c1-17(2)19-7-4-9-21(13-19)28-16-23(25)24-20-8-3-6-18(12-20)14-26-15-22-10-5-11-27-22/h3-13,17H,14-16H2,1-2H3,(H,24,25)
InChIKeyKQWPILGSTWMSGE-UHFFFAOYSA-N
MW379.46 g/mol
LogP5.14
Rot. Bonds9

About N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide

N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide (PubChem CID 55806853) has the molecular formula C23H25NO4 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
PubChem CID55806853
Molecular FormulaC23H25NO4
Molecular Weight379.46 g/mol
Exact Mass379.18
IUPAC NameN-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1cccc(OCC(=O)Nc2cccc(COCc3ccco3)c2)c1
InChIInChI=1S/C23H25NO4/c1-17(2)19-7-4-9-21(13-19)28-16-23(25)24-20-8-3-6-18(12-20)14-26-15-22-10-5-11-27-22/h3-13,17H,14-16H2,1-2H3,(H,24,25)
InChIKeyKQWPILGSTWMSGE-UHFFFAOYSA-N
XLogP5.14
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.46
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[2-[3-(furan-2-ylmethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 55933693
2-(3,4-dimethylphenoxy)-N-[3-(furan-2-ylmethoxymethyl)phenyl]acetamide
CID 55806817
N-(3-acetylphenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 19175983
3,3,3-trifluoro-N-[3-(furan-2-ylmethoxymethyl)phenyl]propanamide
CID 47048652
2-cyclohexyloxy-N-[3-(furan-2-ylmethoxymethyl)phenyl]acetamide
CID 87006772
2-(3-aminophenoxy)-N-(3-propan-2-ylphenyl)acetamide
CID 61035869
2-(2,6-dichlorophenyl)-N-[3-(furan-2-ylmethoxymethyl)phenyl]acetamide
CID 52656585
3-[3-(furan-2-ylmethoxymethyl)phenyl]-1-(2-hydroxypropyl)-1-propan-2-ylurea
CID 111754666
N-(3-acetylphenyl)-2-[3-(furan-2-ylmethoxymethyl)anilino]propanamide
CID 60542221
N-(4-iodophenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 19176026
1-[2-(diethylamino)propyl]-3-[3-(furan-2-ylmethoxymethyl)phenyl]urea
CID 55819935
N-[3-[2-[3-(furan-2-ylmethoxy)propylamino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 86930220

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide (CID 55806853) is N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide is CC(C)c1cccc(OCC(=O)Nc2cccc(COCc3ccco3)c2)c1.
What is the InChIKey of N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The InChIKey is KQWPILGSTWMSGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO4/c1-17(2)19-7-4-9-21(13-19)28-16-23(25)24-20-8-3-6-18(12-20)14-26-15-22-10-5-11-27-22/h3-13,17H,14-16H2,1-2H3,(H,24,25).
What are the key properties of N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide has a molecular weight of 379.46 g/mol, XLogP of 5.14, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-ylmethoxymethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 55806853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).