N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide

C23H24N2O4 — CID 46470414

IUPACN-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide
SMILESO=C(CCNC(=O)c1ccccc1)NCc1cccc(COCc2ccco2)c1
InChIInChI=1S/C23H24N2O4/c26-22(11-12-24-23(27)20-8-2-1-3-9-20)25-15-18-6-4-7-19(14-18)16-28-17-21-10-5-13-29-21/h1-10,13-14H,11-12,15-17H2,(H,24,27)(H,25,26)
InChIKeyRHVHVGDOASGTQT-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.43
Rot. Bonds10

About N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide

N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide (PubChem CID 46470414) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide.

Molecular Properties

Compound NameN-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide
PubChem CID46470414
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide
SMILESO=C(CCNC(=O)c1ccccc1)NCc1cccc(COCc2ccco2)c1
InChIInChI=1S/C23H24N2O4/c26-22(11-12-24-23(27)20-8-2-1-3-9-20)25-15-18-6-4-7-19(14-18)16-28-17-21-10-5-13-29-21/h1-10,13-14H,11-12,15-17H2,(H,24,27)(H,25,26)
InChIKeyRHVHVGDOASGTQT-UHFFFAOYSA-N
XLogP3.43
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-oxo-3-[[3-(phenylmethoxymethyl)phenyl]methylamino]propyl]benzamide
CID 46465050
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(4-methylphenyl)propanamide
CID 55661006
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-4-nitrobenzamide
CID 46434217
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-2-hydroxybenzamide
CID 39180502
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-3-(propanoylamino)benzamide
CID 55842112
N-[3-[[3-(furan-2-ylmethylcarbamoyl)phenyl]methylamino]-3-oxopropyl]-2-methylbenzamide
CID 55877656
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 56812373
N-[4-[[3-(methoxymethyl)phenyl]methylamino]-4-oxobutyl]benzamide
CID 46487585
2-(2,6-dimethylphenoxy)-N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]acetamide
CID 46470415
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 55660962
3-(furan-2-yl)-N-[[3-[[3-(furan-2-yl)propanoylamino]methyl]phenyl]methyl]propanamide
CID 86064144
N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]-2-phenyl-1,3-thiazole-4-carboxamide
CID 55661067

Frequently Asked Questions

What is the IUPAC name of N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide?
The IUPAC name of N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide (CID 46470414) is N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide.
What is the SMILES notation for N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide?
The canonical SMILES for N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide is O=C(CCNC(=O)c1ccccc1)NCc1cccc(COCc2ccco2)c1.
What is the InChIKey of N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide?
The InChIKey is RHVHVGDOASGTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c26-22(11-12-24-23(27)20-8-2-1-3-9-20)25-15-18-6-4-7-19(14-18)16-28-17-21-10-5-13-29-21/h1-10,13-14H,11-12,15-17H2,(H,24,27)(H,25,26).
What are the key properties of N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide?
N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide has a molecular weight of 392.46 g/mol, XLogP of 3.43, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-oxopropyl]benzamide is sourced from PubChem (CID 46470414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).