N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide

C23H24N2O3 — CID 112986552

IUPACN-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide
SMILESCCN(c1ccccc1)c1ccc(NC(=O)c2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C23H24N2O3/c1-4-25(19-8-6-5-7-9-19)20-13-11-18(12-14-20)24-23(26)17-10-15-21(27-2)22(16-17)28-3/h5-16H,4H2,1-3H3,(H,24,26)
InChIKeyIUFGXSWWOMXTCR-UHFFFAOYSA-N
MW376.46 g/mol
LogP5.11
Rot. Bonds7

About N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide

N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide (PubChem CID 112986552) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide
PubChem CID112986552
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide
SMILESCCN(c1ccccc1)c1ccc(NC(=O)c2ccc(OC)c(OC)c2)cc1
InChIInChI=1S/C23H24N2O3/c1-4-25(19-8-6-5-7-9-19)20-13-11-18(12-14-20)24-23(26)17-10-15-21(27-2)22(16-17)28-3/h5-16H,4H2,1-3H3,(H,24,26)
InChIKeyIUFGXSWWOMXTCR-UHFFFAOYSA-N
XLogP5.11
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.46
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethoxyphenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243640
N-[4-(N-ethylanilino)phenyl]-2-methoxybenzamide
CID 112986547
N-[4-[benzyl(methyl)amino]phenyl]-3,4-dimethoxybenzamide
CID 112982300
N-[4-(N-ethylanilino)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 112986562
4-ethoxy-3-methoxy-N-(4-phenylphenyl)benzamide
CID 8880847
N-(4-formylphenyl)-3,4-dimethoxybenzamide
CID 106912264
N-(4-bromophenyl)-3,4-dimethoxybenzamide
CID 855033
3,4-dimethoxy-N-[4-(prop-2-enylamino)phenyl]benzamide
CID 112980100
3-methoxy-N-phenyl-4-phenylmethoxybenzamide
CID 5161412
3,4-dimethoxy-N-[4-(1-phenylethylamino)phenyl]benzamide
CID 112982231
N-[4-(aminomethyl)phenyl]-3,4-dimethoxybenzamide
CID 16793219
4-methoxy-3-phenoxy-N-phenylbenzamide
CID 18626251

Frequently Asked Questions

What is the IUPAC name of N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide?
The IUPAC name of N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide (CID 112986552) is N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide.
What is the SMILES notation for N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide?
The canonical SMILES for N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide is CCN(c1ccccc1)c1ccc(NC(=O)c2ccc(OC)c(OC)c2)cc1.
What is the InChIKey of N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide?
The InChIKey is IUFGXSWWOMXTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-4-25(19-8-6-5-7-9-19)20-13-11-18(12-14-20)24-23(26)17-10-15-21(27-2)22(16-17)28-3/h5-16H,4H2,1-3H3,(H,24,26).
What are the key properties of N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide?
N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide has a molecular weight of 376.46 g/mol, XLogP of 5.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(N-ethylanilino)phenyl]-3,4-dimethoxybenzamide is sourced from PubChem (CID 112986552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).