N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide

C25H26N2O5 — CID 130227528

IUPACN-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide
SMILESC=C(c1cc(OC)c(OC)c(OC)c1)c1ccc(OC)c(C(=O)Nc2ccccc2N)c1
InChIInChI=1S/C25H26N2O5/c1-15(17-13-22(30-3)24(32-5)23(14-17)31-4)16-10-11-21(29-2)18(12-16)25(28)27-20-9-7-6-8-19(20)26/h6-14H,1,26H2,2-5H3,(H,27,28)
InChIKeyNROHGWLRINKWTG-UHFFFAOYSA-N
MW434.49 g/mol
LogP4.62
Rot. Bonds8

About N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide

N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide (PubChem CID 130227528) has the molecular formula C25H26N2O5 and a molecular weight of 434.49 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide
PubChem CID130227528
Molecular FormulaC25H26N2O5
Molecular Weight434.49 g/mol
Exact Mass434.18
IUPAC NameN-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide
SMILESC=C(c1cc(OC)c(OC)c(OC)c1)c1ccc(OC)c(C(=O)Nc2ccccc2N)c1
InChIInChI=1S/C25H26N2O5/c1-15(17-13-22(30-3)24(32-5)23(14-17)31-4)16-10-11-21(29-2)18(12-16)25(28)27-20-9-7-6-8-19(20)26/h6-14H,1,26H2,2-5H3,(H,27,28)
InChIKeyNROHGWLRINKWTG-UHFFFAOYSA-N
XLogP4.62
TPSA92.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.49
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3,4,5-Trimethoxybenzanilide
CID 305103
2,4,5-trimethoxy-N-(1-naphthyl)benzamide
CID 837977
N-(3-ethylphenyl)-3,4,5-trimethoxybenzamide
CID 897201
N-(4-benzoylphenyl)-2,4,5-trimethoxybenzamide
CID 1020050
(2-Oxo-1,2-dihydroquinolin-3-yl)methyl 3,4,5-trimethoxybenzoate
CID 664503
3,4,5-trimethoxy-N-(2-piperidin-1-ylphenyl)benzamide
CID 2803242
N-[4-(3-acetylphenyl)-2-nitrophenyl]-3,4,5-trimethoxybenzamide
CID 56945196
3,4,5-trimethoxy-N-(2-nitro-5-phenylphenyl)benzamide
CID 56946831
3-(3,4,5-trimethoxybenzoyl)-1H-quinoxalin-2-one
CID 141466063
2-methoxy-N-[4-(5,6,7-trimethoxy-4-oxochromen-2-yl)phenyl]benzamide
CID 142727316
(E)-N-(2-aminophenyl)-3-[2-methoxy-5-(3,4,5-trimethoxybenzoyl)phenyl]prop-2-enamide
CID 164618780
N-(2-aminophenyl)-4-[[2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]methyl]benzamide
CID 164621119

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide?
The IUPAC name of N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide (CID 130227528) is N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide.
What is the SMILES notation for N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide?
The canonical SMILES for N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide is C=C(c1cc(OC)c(OC)c(OC)c1)c1ccc(OC)c(C(=O)Nc2ccccc2N)c1.
What is the InChIKey of N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide?
The InChIKey is NROHGWLRINKWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O5/c1-15(17-13-22(30-3)24(32-5)23(14-17)31-4)16-10-11-21(29-2)18(12-16)25(28)27-20-9-7-6-8-19(20)26/h6-14H,1,26H2,2-5H3,(H,27,28).
What are the key properties of N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide?
N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide has a molecular weight of 434.49 g/mol, XLogP of 4.62, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-2-methoxy-5-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzamide is sourced from PubChem (CID 130227528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).