N-[2-(1H-indol-3-yl)ethyl]benzamide

C17H16N2O — CID 684658

IUPACN-[2-(1H-indol-3-yl)ethyl]benzamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C17H16N2O/c20-17(13-6-2-1-3-7-13)18-11-10-14-12-19-16-9-5-4-8-15(14)16/h1-9,12,19H,10-11H2,(H,18,20)
InChIKeyKTEDBFKQSUUOQJ-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.14
Rot. Bonds4

About N-[2-(1H-indol-3-yl)ethyl]benzamide

N-[2-(1H-indol-3-yl)ethyl]benzamide (PubChem CID 684658) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]benzamide
PubChem CID684658
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]benzamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C17H16N2O/c20-17(13-6-2-1-3-7-13)18-11-10-14-12-19-16-9-5-4-8-15(14)16/h1-9,12,19H,10-11H2,(H,18,20)
InChIKeyKTEDBFKQSUUOQJ-UHFFFAOYSA-N
XLogP3.14
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze N-[2-(1H-indol-3-yl)ethyl]benzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]benzamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]benzamide (CID 684658) is N-[2-(1H-indol-3-yl)ethyl]benzamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]benzamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]benzamide is O=C(NCCc1c[nH]c2ccccc12)c1ccccc1.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]benzamide?
The InChIKey is KTEDBFKQSUUOQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c20-17(13-6-2-1-3-7-13)18-11-10-14-12-19-16-9-5-4-8-15(14)16/h1-9,12,19H,10-11H2,(H,18,20).
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]benzamide?
N-[2-(1H-indol-3-yl)ethyl]benzamide has a molecular weight of 264.33 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]benzamide is sourced from PubChem (CID 684658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).