N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide

C25H24N2O3 — CID 84573070

IUPACN-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)Cn1ccc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C25H24N2O3/c1-18-11-12-24(29-2)21(15-18)26-25(28)16-27-14-13-20-22(27)9-6-10-23(20)30-17-19-7-4-3-5-8-19/h3-15H,16-17H2,1-2H3,(H,26,28)
InChIKeyXLICMPTYLWASGQ-UHFFFAOYSA-N
MW400.48 g/mol
LogP5.18
Rot. Bonds7

About N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide

N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide (PubChem CID 84573070) has the molecular formula C25H24N2O3 and a molecular weight of 400.48 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide
PubChem CID84573070
Molecular FormulaC25H24N2O3
Molecular Weight400.48 g/mol
Exact Mass400.18
IUPAC NameN-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)Cn1ccc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C25H24N2O3/c1-18-11-12-24(29-2)21(15-18)26-25(28)16-27-14-13-20-22(27)9-6-10-23(20)30-17-19-7-4-3-5-8-19/h3-15H,16-17H2,1-2H3,(H,26,28)
InChIKeyXLICMPTYLWASGQ-UHFFFAOYSA-N
XLogP5.18
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.48
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)ethanone
CID 84571772
N-(2-methoxy-5-methylphenyl)-2-(4-oxo-5H-pyrrolo[3,2-c]pyridin-1-yl)acetamide
CID 46395627
1-ethyl-4-phenylmethoxyindole
CID 24776902
2-(4-chloroindol-1-yl)-N-(2,5-dimethoxyphenyl)acetamide
CID 39314339
2-[3-[(3-fluorophenyl)methylsulfonyl]indol-1-yl]-N-(2-methoxy-5-methylphenyl)acetamide
CID 30292321
2-(benzylcarbamoylamino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 24559532
2-[2-(benzylamino)benzimidazol-1-yl]-N-(2-methoxy-5-methylphenyl)acetamide
CID 9119353
N-(2-methoxy-5-methylphenyl)-2-[(3-methylphenyl)methylamino]acetamide
CID 108996806
(E)-N-(2-methoxy-5-methylphenyl)-3-(3-methoxy-2-phenylmethoxyphenyl)prop-2-enamide
CID 51057815
N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-3-phenylmethoxybenzamide
CID 46551015
2-[4-(benzylamino)-2-oxoquinazolin-1-yl]-N-(2-methoxy-5-methylphenyl)acetamide
CID 56685527
2-(7-bromo-4-oxoquinolin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 100740360

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide (CID 84573070) is N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide is COc1ccc(C)cc1NC(=O)Cn1ccc2c(OCc3ccccc3)cccc21.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide?
The InChIKey is XLICMPTYLWASGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O3/c1-18-11-12-24(29-2)21(15-18)26-25(28)16-27-14-13-20-22(27)9-6-10-23(20)30-17-19-7-4-3-5-8-19/h3-15H,16-17H2,1-2H3,(H,26,28).
What are the key properties of N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide?
N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide has a molecular weight of 400.48 g/mol, XLogP of 5.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide is sourced from PubChem (CID 84573070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).