3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide

C26H24N2O3 — CID 46481923

IUPAC3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide
SMILESO=C(CCc1ccc(-c2ccccc2)o1)NCc1cccc(OCc2ccccn2)c1
InChIInChI=1S/C26H24N2O3/c29-26(15-13-23-12-14-25(31-23)21-8-2-1-3-9-21)28-18-20-7-6-11-24(17-20)30-19-22-10-4-5-16-27-22/h1-12,14,16-17H,13,15,18-19H2,(H,28,29)
InChIKeyQHPSLNKYBUVWED-UHFFFAOYSA-N
MW412.49 g/mol
LogP5.17
Rot. Bonds9

About 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide

3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide (PubChem CID 46481923) has the molecular formula C26H24N2O3 and a molecular weight of 412.49 g/mol. Its IUPAC name is 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide.

Molecular Properties

Compound Name3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide
PubChem CID46481923
Molecular FormulaC26H24N2O3
Molecular Weight412.49 g/mol
Exact Mass412.18
IUPAC Name3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide
SMILESO=C(CCc1ccc(-c2ccccc2)o1)NCc1cccc(OCc2ccccn2)c1
InChIInChI=1S/C26H24N2O3/c29-26(15-13-23-12-14-25(31-23)21-8-2-1-3-9-21)28-18-20-7-6-11-24(17-20)30-19-22-10-4-5-16-27-22/h1-12,14,16-17H,13,15,18-19H2,(H,28,29)
InChIKeyQHPSLNKYBUVWED-UHFFFAOYSA-N
XLogP5.17
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.49
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,6-dimethylphenoxy)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]acetamide
CID 46478039
5-(methoxymethyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]furan-2-carboxamide
CID 78875904
5-oxo-5-[[3-(pyridin-2-ylmethoxy)phenyl]methylamino]pent-2-enoic acid
CID 75134507
3-(5-phenylfuran-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide
CID 9483404
2-(2-chlorophenoxy)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]acetamide
CID 46590568
N-[[6-(3-methoxyphenoxy)-3-pyridinyl]methyl]-3-(5-phenylfuran-2-yl)propanamide
CID 55800755
3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide
CID 55709557
N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 46470158
N'-[2-(3-methylphenoxy)acetyl]-3-(5-phenylfuran-2-yl)propanehydrazide
CID 35767998
N-(3-phenoxypropyl)-3-(5-phenylfuran-2-yl)propanamide
CID 18120278
2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]acetamide
CID 55714430
2,4-difluoro-N-[3-oxo-3-[[3-(pyridin-2-ylmethoxy)phenyl]methylamino]propyl]benzamide
CID 46470248

Frequently Asked Questions

What is the IUPAC name of 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide?
The IUPAC name of 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide (CID 46481923) is 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide.
What is the SMILES notation for 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide?
The canonical SMILES for 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide is O=C(CCc1ccc(-c2ccccc2)o1)NCc1cccc(OCc2ccccn2)c1.
What is the InChIKey of 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide?
The InChIKey is QHPSLNKYBUVWED-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O3/c29-26(15-13-23-12-14-25(31-23)21-8-2-1-3-9-21)28-18-20-7-6-11-24(17-20)30-19-22-10-4-5-16-27-22/h1-12,14,16-17H,13,15,18-19H2,(H,28,29).
What are the key properties of 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide?
3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide has a molecular weight of 412.49 g/mol, XLogP of 5.17, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-phenylfuran-2-yl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]propanamide is sourced from PubChem (CID 46481923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).