2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide

C23H25NO4 — CID 57327688

IUPAC2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCc2ccc(C)cc2)C(c2ccc(OC)c(OC)c2)OC1
InChIInChI=1S/C23H25NO4/c1-5-17-14-28-22(18-10-11-19(26-3)20(12-18)27-4)21(17)23(25)24-13-16-8-6-15(2)7-9-16/h5-12,22H,1,13-14H2,2-4H3,(H,24,25)
InChIKeyYODVMVARUMTZAU-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.88
Rot. Bonds7

About 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide

2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide (PubChem CID 57327688) has the molecular formula C23H25NO4 and a molecular weight of 379.46 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide
PubChem CID57327688
Molecular FormulaC23H25NO4
Molecular Weight379.46 g/mol
Exact Mass379.18
IUPAC Name2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCc2ccc(C)cc2)C(c2ccc(OC)c(OC)c2)OC1
InChIInChI=1S/C23H25NO4/c1-5-17-14-28-22(18-10-11-19(26-3)20(12-18)27-4)21(17)23(25)24-13-16-8-6-15(2)7-9-16/h5-12,22H,1,13-14H2,2-4H3,(H,24,25)
InChIKeyYODVMVARUMTZAU-UHFFFAOYSA-N
XLogP3.88
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-[(3,4-dimethoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]oxamide
CID 108984830
5-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 2671578
2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
CID 743463
3-bromo-4-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 27259778
N-[[4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-4-yl]phenyl]methyl]-3,5-dimethylbenzamide
CID 23108978
2,4-dimethoxy-3-methyl-N-[(4-methylphenyl)methyl]benzamide
CID 110763344
2-(2-methoxy-4-methylphenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 2627667
2-amino-3,4,5-trimethoxy-N-[(4-methylphenyl)methyl]benzamide
CID 110181256
3-acetamido-4-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 110764229
5-amino-N-[[4-(hydroxymethyl)phenyl]methyl]-2-methoxybenzamide
CID 107229452
4-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 47449992
6-[(3,4-dimethoxyphenyl)methylamino]-N-[(4-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109347409

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide (CID 57327688) is 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide is C=CC1=C(C(=O)NCc2ccc(C)cc2)C(c2ccc(OC)c(OC)c2)OC1.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
The InChIKey is YODVMVARUMTZAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO4/c1-5-17-14-28-22(18-10-11-19(26-3)20(12-18)27-4)21(17)23(25)24-13-16-8-6-15(2)7-9-16/h5-12,22H,1,13-14H2,2-4H3,(H,24,25).
What are the key properties of 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 3.88, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-4-ethenyl-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide is sourced from PubChem (CID 57327688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).