N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide

C22H26N2O4 — CID 53057512

IUPACN-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
SMILESCOc1ccc(OC)c(CNC(=O)CN2C(=O)C(C)(C)c3cc(C)ccc32)c1
InChIInChI=1S/C22H26N2O4/c1-14-6-8-18-17(10-14)22(2,3)21(26)24(18)13-20(25)23-12-15-11-16(27-4)7-9-19(15)28-5/h6-11H,12-13H2,1-5H3,(H,23,25)
InChIKeyWBEFTCFIXZQUON-UHFFFAOYSA-N
MW382.46 g/mol
LogP2.95
Rot. Bonds6

About N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide

N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide (PubChem CID 53057512) has the molecular formula C22H26N2O4 and a molecular weight of 382.46 g/mol. Its IUPAC name is N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide.

Molecular Properties

Compound NameN-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
PubChem CID53057512
Molecular FormulaC22H26N2O4
Molecular Weight382.46 g/mol
Exact Mass382.19
IUPAC NameN-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
SMILESCOc1ccc(OC)c(CNC(=O)CN2C(=O)C(C)(C)c3cc(C)ccc32)c1
InChIInChI=1S/C22H26N2O4/c1-14-6-8-18-17(10-14)22(2,3)21(26)24(18)13-20(25)23-12-15-11-16(27-4)7-9-19(15)28-5/h6-11H,12-13H2,1-5H3,(H,23,25)
InChIKeyWBEFTCFIXZQUON-UHFFFAOYSA-N
XLogP2.95
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethoxyphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
CID 53057438
N-[(4-chlorophenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
CID 53057430
2-(3,3-dimethyl-2-oxoindol-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide
CID 22583355
N-[(3,4-dimethoxyphenyl)methyl]-2-(3,3-dimethyl-2-oxoindol-1-yl)acetamide
CID 53057385
2-(3,3-dimethyl-2-oxo-5-piperidin-1-ylsulfonylindol-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 22583332
N-[(2,5-dimethoxyphenyl)methyl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 33103569
N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
CID 53057444
3-[(2-methoxy-5-methylphenyl)methylamino]-3-oxopropanoic acid
CID 115163375
2-chloro-N-[(2-methoxy-5-methylphenyl)methyl]acetamide
CID 82128305
N-[(2,5-dimethoxyphenyl)methyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
CID 50768132
N-[(2,5-dimethoxyphenyl)methyl]-3-methylbenzamide
CID 33097699
3-hydroxy-N-[(2-methoxy-5-methylphenyl)methyl]propanamide
CID 115138980

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The IUPAC name of N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide (CID 53057512) is N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide.
What is the SMILES notation for N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The canonical SMILES for N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide is COc1ccc(OC)c(CNC(=O)CN2C(=O)C(C)(C)c3cc(C)ccc32)c1.
What is the InChIKey of N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The InChIKey is WBEFTCFIXZQUON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4/c1-14-6-8-18-17(10-14)22(2,3)21(26)24(18)13-20(25)23-12-15-11-16(27-4)7-9-19(15)28-5/h6-11H,12-13H2,1-5H3,(H,23,25).
What are the key properties of N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide has a molecular weight of 382.46 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethoxyphenyl)methyl]-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide is sourced from PubChem (CID 53057512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).