N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide

C25H33N3O6 — CID 4850126

IUPACN-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cc(OC)c1OC
InChIInChI=1S/C25H33N3O6/c1-30-22-14-18(15-23(31-2)25(22)32-3)16-24(29)26-20-5-4-19(27-6-10-33-11-7-27)17-21(20)28-8-12-34-13-9-28/h4-5,14-15,17H,6-13,16H2,1-3H3,(H,26,29)
InChIKeyHRVGBVBFQMDYTQ-UHFFFAOYSA-N
MW471.55 g/mol
LogP2.57
Rot. Bonds8

About N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide

N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 4850126) has the molecular formula C25H33N3O6 and a molecular weight of 471.55 g/mol. Its IUPAC name is N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID4850126
Molecular FormulaC25H33N3O6
Molecular Weight471.55 g/mol
Exact Mass471.24
IUPAC NameN-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cc(OC)c1OC
InChIInChI=1S/C25H33N3O6/c1-30-22-14-18(15-23(31-2)25(22)32-3)16-24(29)26-20-5-4-19(27-6-10-33-11-7-27)17-21(20)28-8-12-34-13-9-28/h4-5,14-15,17H,6-13,16H2,1-3H3,(H,26,29)
InChIKeyHRVGBVBFQMDYTQ-UHFFFAOYSA-N
XLogP2.57
TPSA81.73 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.55
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-morpholin-4-ylphenyl)acetamide
CID 110427902
N-(4-morpholin-4-ylphenyl)-2-(3,4,5-trimethoxyanilino)acetamide
CID 55362335
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2,4-dimorpholin-4-ylphenyl)acetamide
CID 112771327
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-(2,4-dimorpholin-4-ylphenyl)acetamide
CID 112761780
2-(2-methoxyphenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 2677631
3,4,5-trimethoxy-N-(2-methyl-5-morpholin-4-ylphenyl)benzamide
CID 110362463
4-amino-N-(2,4-dimorpholin-4-ylphenyl)butanamide
CID 119900958
N-(2-methoxy-5-morpholin-4-ylphenyl)pentanamide
CID 110359739
N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 38748683
2-(2-bromo-4,5-dimethoxyphenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 17426993
N-(2-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2599423
(2S)-2-amino-N-(2,4-dimorpholin-4-ylphenyl)butanamide;trihydrochloride
CID 119900951

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide (CID 4850126) is N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide is COc1cc(CC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cc(OC)c1OC.
What is the InChIKey of N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is HRVGBVBFQMDYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N3O6/c1-30-22-14-18(15-23(31-2)25(22)32-3)16-24(29)26-20-5-4-19(27-6-10-33-11-7-27)17-21(20)28-8-12-34-13-9-28/h4-5,14-15,17H,6-13,16H2,1-3H3,(H,26,29).
What are the key properties of N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide?
N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 471.55 g/mol, XLogP of 2.57, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimorpholin-4-ylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 4850126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).