2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide

C23H21N3O3 — CID 110204765

IUPAC2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide
SMILESCOc1ncccc1NC(=O)COc1cccc2c1ccn2Cc1ccccc1
InChIInChI=1S/C23H21N3O3/c1-28-23-19(9-6-13-24-23)25-22(27)16-29-21-11-5-10-20-18(21)12-14-26(20)15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,25,27)
InChIKeyCXPBUGGOPLTCJY-UHFFFAOYSA-N
MW387.44 g/mol
LogP4.11
Rot. Bonds7

About 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide

2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide (PubChem CID 110204765) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide
PubChem CID110204765
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC Name2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide
SMILESCOc1ncccc1NC(=O)COc1cccc2c1ccn2Cc1ccccc1
InChIInChI=1S/C23H21N3O3/c1-28-23-19(9-6-13-24-23)25-22(27)16-29-21-11-5-10-20-18(21)12-14-26(20)15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,25,27)
InChIKeyCXPBUGGOPLTCJY-UHFFFAOYSA-N
XLogP4.11
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxy-3-pyridinyl)-2-(1-methylindol-4-yl)oxyacetamide
CID 91821935
N-(1-benzylindol-4-yl)-3-hydroxypropanamide
CID 176845425
2-hydroxy-N-(2-methoxy-3-pyridinyl)acetamide
CID 126992524
N-(2-methoxy-5-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)acetamide
CID 84573070
2-(4-fluorophenyl)-N-(2-methoxy-3-pyridinyl)acetamide
CID 47043618
1-(2-methoxyphenyl)-3-[1-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)indol-4-yl]urea
CID 50995115
N-(2-methoxy-3-pyridinyl)-2-[4-(4-methylphenoxy)phenoxy]acetamide
CID 55795022
N-(2-methoxy-3-pyridinyl)-3-phenyl-3-pyrrol-1-ylpropanamide
CID 110204604
2-(2,5-dimethylpyrrol-1-yl)-N-(2-methoxy-3-pyridinyl)acetamide
CID 110204770
3-amino-N-(2-methoxy-3-pyridinyl)-3-phenylpropanamide
CID 43708900
2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide
CID 65102015
2-(2-aminophenoxy)-N-(2-methyl-3-pyridinyl)acetamide
CID 79042181

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide (CID 110204765) is 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide is COc1ncccc1NC(=O)COc1cccc2c1ccn2Cc1ccccc1.
What is the InChIKey of 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide?
The InChIKey is CXPBUGGOPLTCJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-28-23-19(9-6-13-24-23)25-22(27)16-29-21-11-5-10-20-18(21)12-14-26(20)15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,25,27).
What are the key properties of 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide?
2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide has a molecular weight of 387.44 g/mol, XLogP of 4.11, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzylindol-4-yl)oxy-N-(2-methoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 110204765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).