2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide

C18H18N2O2 — CID 4224442

IUPAC2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CNC(=O)Cn2ccc3ccccc32)cc1
InChIInChI=1S/C18H18N2O2/c1-22-16-8-6-14(7-9-16)12-19-18(21)13-20-11-10-15-4-2-3-5-17(15)20/h2-11H,12-13H2,1H3,(H,19,21)
InChIKeySRQWRIPBOIFXMT-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.97
Rot. Bonds5

About 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide

2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide (PubChem CID 4224442) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide
PubChem CID4224442
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CNC(=O)Cn2ccc3ccccc32)cc1
InChIInChI=1S/C18H18N2O2/c1-22-16-8-6-14(7-9-16)12-19-18(21)13-20-11-10-15-4-2-3-5-17(15)20/h2-11H,12-13H2,1H3,(H,19,21)
InChIKeySRQWRIPBOIFXMT-UHFFFAOYSA-N
XLogP2.97
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(7-methoxyindol-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 39348357
2-indol-1-yl-N-[2-(4-methoxyphenoxy)ethyl]acetamide
CID 110702432
N-(cyanomethyl)-2-indol-1-ylacetamide
CID 55220475
2-(6-chloro-4-oxoquinolin-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 100734852
N-[(4-fluorophenyl)methyl]-4-[2-(2-indol-1-ylacetyl)hydrazinyl]-4-oxobutanamide
CID 3336665
N-[(3-bromophenyl)methyl]-2-(5-methoxyindol-1-yl)acetamide
CID 55718467
N-[(4-methoxyphenyl)methyl]-2-[1-[(2-methylphenyl)methyl]-7-oxopyrrolo[2,3-c]pyridin-6-yl]acetamide
CID 52906439
N'-(2-indol-1-ylacetyl)-2-(4-methoxyphenoxy)propanehydrazide
CID 17080332
N-[(4-methoxyphenyl)methyl]-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502426
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
N-(3,5-difluoro-4-methoxyphenyl)-2-indol-1-ylacetamide
CID 87042646
2-[(4-ethoxyphenyl)methyl]-3-[(2-indol-1-ylacetyl)amino]propanoic acid
CID 119232177

Frequently Asked Questions

What is the IUPAC name of 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide (CID 4224442) is 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide is COc1ccc(CNC(=O)Cn2ccc3ccccc32)cc1.
What is the InChIKey of 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide?
The InChIKey is SRQWRIPBOIFXMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-22-16-8-6-14(7-9-16)12-19-18(21)13-20-11-10-15-4-2-3-5-17(15)20/h2-11H,12-13H2,1H3,(H,19,21).
What are the key properties of 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide?
2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide has a molecular weight of 294.35 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 4224442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).