N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide

C18H18N2O2 — CID 155518161

IUPACN-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2c(ccn2C)c1
InChIInChI=1S/C18H18N2O2/c1-13-5-3-4-6-17(13)22-12-18(21)19-15-7-8-16-14(11-15)9-10-20(16)2/h3-11H,12H2,1-2H3,(H,19,21)
InChIKeyOEVYBLHOFAXAJL-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.50
Rot. Bonds4

About N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide

N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide (PubChem CID 155518161) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide
PubChem CID155518161
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2c(ccn2C)c1
InChIInChI=1S/C18H18N2O2/c1-13-5-3-4-6-17(13)22-12-18(21)19-15-7-8-16-14(11-15)9-10-20(16)2/h3-11H,12H2,1-2H3,(H,19,21)
InChIKeyOEVYBLHOFAXAJL-UHFFFAOYSA-N
XLogP3.50
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-((4-(2-(1H-Indol-1-yl)ethoxy)phenyl)methyl)-2,4-thiazolidinedione
CID 154005
N-Acetyl-5-benzyloxytryptamine
CID 563605
Benzyl-[2-(1H-indol-4-yloxy)-ethyl]-amine
CID 9838216
[2-(1H-Indol-4-yloxy)-ethyl]-(4-phenyl-butyl)-amine
CID 9861435
2-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-1-(4-phenyl-piperazin-1-yl)-ethanone
CID 9999722
2-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-1-[4-(4-aminomethyl-phenyl)-piperazin-1-yl]-ethanone
CID 10250834
N-[(R)-1-{[Acetyl-(2-methoxy-benzyl)-amino]-methyl}-2-(1H-indol-3-yl)-ethyl]-2-(4-hydroxymethyl-phenoxy)-acetamide
CID 11756257
2-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-N-{2-[3-(2-amino-ethyl)-1H-indol-5-yloxy]-ethyl}-acetamide
CID 11797158
1N-{2-(1H-3-indolyl)-1-[2-methoxybenzyl(methyl)carboxamidomethyl]ethyl}-2-(4-hydroxymethylphenoxy)acetamide
CID 18709649
N-[2-[5-(2-phenylethoxy)-1H-indol-3-yl]ethyl]acetamide
CID 56653119
methyl (2E)-2-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}hydrazinecarboxylate
CID 6880792
3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide
CID 4879910

Frequently Asked Questions

What is the IUPAC name of N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide (CID 155518161) is N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)Nc1ccc2c(ccn2C)c1.
What is the InChIKey of N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide?
The InChIKey is OEVYBLHOFAXAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-13-5-3-4-6-17(13)22-12-18(21)19-15-7-8-16-14(11-15)9-10-20(16)2/h3-11H,12H2,1-2H3,(H,19,21).
What are the key properties of N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide?
N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide has a molecular weight of 294.35 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylindol-5-yl)-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 155518161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).