N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide

C23H28N2O6 — CID 42944718

IUPACN-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2C(=O)N2CC(C)OC(C)C2)cc(OC)c1OC
InChIInChI=1S/C23H28N2O6/c1-14-12-25(13-15(2)31-14)23(27)17-8-6-7-9-18(17)24-22(26)16-10-19(28-3)21(30-5)20(11-16)29-4/h6-11,14-15H,12-13H2,1-5H3,(H,24,26)
InChIKeyZFTNUQCDINWECX-UHFFFAOYSA-N
MW428.49 g/mol
LogP3.21
Rot. Bonds6

About N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide

N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide (PubChem CID 42944718) has the molecular formula C23H28N2O6 and a molecular weight of 428.49 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide
PubChem CID42944718
Molecular FormulaC23H28N2O6
Molecular Weight428.49 g/mol
Exact Mass428.19
IUPAC NameN-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2C(=O)N2CC(C)OC(C)C2)cc(OC)c1OC
InChIInChI=1S/C23H28N2O6/c1-14-12-25(13-15(2)31-14)23(27)17-8-6-7-9-18(17)24-22(26)16-10-19(28-3)21(30-5)20(11-16)29-4/h6-11,14-15H,12-13H2,1-5H3,(H,24,26)
InChIKeyZFTNUQCDINWECX-UHFFFAOYSA-N
XLogP3.21
TPSA86.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.49
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]benzamide
CID 42888700
N-[2-(azepane-1-carbonyl)phenyl]-3,4,5-trimethoxybenzamide
CID 4937859
3,4,5-trimethoxy-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]benzamide
CID 3163319
N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-4-methoxy-3-nitrobenzamide
CID 42893742
3,4,5-trimethoxy-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]benzamide
CID 7258591
4-(2-amino-2-oxoethoxy)-N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-3,5-dimethoxybenzamide
CID 55677040
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-3,4-dimethoxy-5-prop-2-enylbenzamide
CID 55677135
3-chloro-4,5-dimethoxy-N-[2-(piperidine-1-carbonyl)phenyl]benzamide
CID 26905325
3,4,5-trimethoxy-N-[2-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 990875
N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3-methyl-4-nitrobenzamide
CID 42944721
N-[2-(benzamidocarbamoyl)phenyl]-3,4,5-trimethoxybenzamide
CID 126008715
N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(4-methoxyphenyl)acetamide
CID 42944717

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide (CID 42944718) is N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide is COc1cc(C(=O)Nc2ccccc2C(=O)N2CC(C)OC(C)C2)cc(OC)c1OC.
What is the InChIKey of N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide?
The InChIKey is ZFTNUQCDINWECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O6/c1-14-12-25(13-15(2)31-14)23(27)17-8-6-7-9-18(17)24-22(26)16-10-19(28-3)21(30-5)20(11-16)29-4/h6-11,14-15H,12-13H2,1-5H3,(H,24,26).
What are the key properties of N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide?
N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide has a molecular weight of 428.49 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-3,4,5-trimethoxybenzamide is sourced from PubChem (CID 42944718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).