N-benzyl-5-methoxyindole-1-carboxamide

C17H16N2O2 — CID 11055060

IUPACN-benzyl-5-methoxyindole-1-carboxamide
SMILESCOc1ccc2c(ccn2C(=O)NCc2ccccc2)c1
InChIInChI=1S/C17H16N2O2/c1-21-15-7-8-16-14(11-15)9-10-19(16)17(20)18-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,18,20)
InChIKeyUVEHXWXYMZNHHH-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.41
Rot. Bonds3

About N-benzyl-5-methoxyindole-1-carboxamide

N-benzyl-5-methoxyindole-1-carboxamide (PubChem CID 11055060) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-benzyl-5-methoxyindole-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-5-methoxyindole-1-carboxamide
PubChem CID11055060
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC NameN-benzyl-5-methoxyindole-1-carboxamide
SMILESCOc1ccc2c(ccn2C(=O)NCc2ccccc2)c1
InChIInChI=1S/C17H16N2O2/c1-21-15-7-8-16-14(11-15)9-10-19(16)17(20)18-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,18,20)
InChIKeyUVEHXWXYMZNHHH-UHFFFAOYSA-N
XLogP3.41
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-benzyl-5-methoxyindole-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methoxyindole-1-carboxylic acid
CID 68566461
5-methoxy-N-(4-methoxyphenyl)indole-1-carboxamide
CID 173299571
N-benzyl-N-(2-bromophenyl)-5-methoxyindole-1-carboxamide
CID 102348592
5-methoxy-1-(1-phenylethenyl)indole
CID 175370512
N-[(3-bromophenyl)methyl]-2-(5-methoxyindol-1-yl)acetamide
CID 55718467
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
N-[(4-methylsulfanylphenyl)methyl]indole-1-carboxamide
CID 171536191
(2S)-N-(benzylcarbamoyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
CID 8949497
N-benzyl-2-(4-methoxyphenyl)sulfanylacetamide
CID 41320624
benzyl N-[(2R)-1-(5-methoxyindol-1-yl)propan-2-yl]carbamate
CID 178146603
2-indol-1-yl-N-[(4-methoxyphenyl)methyl]acetamide
CID 4224442
cyanomethyl 5-methoxyindole-1-carboxylate
CID 141286697

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-methoxyindole-1-carboxamide?
The IUPAC name of N-benzyl-5-methoxyindole-1-carboxamide (CID 11055060) is N-benzyl-5-methoxyindole-1-carboxamide.
What is the SMILES notation for N-benzyl-5-methoxyindole-1-carboxamide?
The canonical SMILES for N-benzyl-5-methoxyindole-1-carboxamide is COc1ccc2c(ccn2C(=O)NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-5-methoxyindole-1-carboxamide?
The InChIKey is UVEHXWXYMZNHHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-21-15-7-8-16-14(11-15)9-10-19(16)17(20)18-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,18,20).
What are the key properties of N-benzyl-5-methoxyindole-1-carboxamide?
N-benzyl-5-methoxyindole-1-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-methoxyindole-1-carboxamide is sourced from PubChem (CID 11055060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).