3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide

C24H20N2O4 — CID 38668380

IUPAC3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(OCc2ccccn2)c1)c1occc1COc1ccccc1
InChIInChI=1S/C24H20N2O4/c27-24(23-18(12-14-28-23)16-29-21-9-2-1-3-10-21)26-19-8-6-11-22(15-19)30-17-20-7-4-5-13-25-20/h1-15H,16-17H2,(H,26,27)
InChIKeyXKOPBXPMRRCJKM-UHFFFAOYSA-N
MW400.43 g/mol
LogP5.08
Rot. Bonds8

About 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide

3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide (PubChem CID 38668380) has the molecular formula C24H20N2O4 and a molecular weight of 400.43 g/mol. Its IUPAC name is 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide
PubChem CID38668380
Molecular FormulaC24H20N2O4
Molecular Weight400.43 g/mol
Exact Mass400.14
IUPAC Name3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(OCc2ccccn2)c1)c1occc1COc1ccccc1
InChIInChI=1S/C24H20N2O4/c27-24(23-18(12-14-28-23)16-29-21-9-2-1-3-10-21)26-19-8-6-11-22(15-19)30-17-20-7-4-5-13-25-20/h1-15H,16-17H2,(H,26,27)
InChIKeyXKOPBXPMRRCJKM-UHFFFAOYSA-N
XLogP5.08
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.43
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 30804525
4-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 38670554
ethyl 3-[[3-(phenoxymethyl)furan-2-carbonyl]amino]benzoate
CID 34202497
3-phenylmethoxy-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 33498503
N-(1,3-benzodioxol-5-yl)-3-(phenoxymethyl)furan-2-carboxamide
CID 25398439
methyl 2-[[3-[[3-(phenoxymethyl)furan-2-carbonyl]amino]benzoyl]amino]acetate
CID 55750582
5-chloro-2-iodo-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 55691116
(2S)-2-hydroxy-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]acetamide
CID 75514519
N-(2,4-difluorophenyl)-3-(phenoxymethyl)furan-2-carboxamide
CID 17493088
2-[benzenesulfonyl(methyl)amino]-N-[3-(pyridin-2-ylmethoxy)phenyl]acetamide
CID 38667056
3-methyl-N-[3-(pyridin-2-ylmethoxy)phenyl]-1-benzothiophene-2-carboxamide
CID 38669121
3-[(3-cyanophenoxy)methyl]-N-(3-ethylsulfonylphenyl)furan-2-carboxamide
CID 86971496

Frequently Asked Questions

What is the IUPAC name of 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide?
The IUPAC name of 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide (CID 38668380) is 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide.
What is the SMILES notation for 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide?
The canonical SMILES for 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide is O=C(Nc1cccc(OCc2ccccn2)c1)c1occc1COc1ccccc1.
What is the InChIKey of 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide?
The InChIKey is XKOPBXPMRRCJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O4/c27-24(23-18(12-14-28-23)16-29-21-9-2-1-3-10-21)26-19-8-6-11-22(15-19)30-17-20-7-4-5-13-25-20/h1-15H,16-17H2,(H,26,27).
What are the key properties of 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide?
3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide has a molecular weight of 400.43 g/mol, XLogP of 5.08, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide is sourced from PubChem (CID 38668380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).