2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide

C22H26N2O — CID 10449567

IUPAC2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C22H26N2O/c1-3-14-24(15-4-2)21(25)16-19-18-12-8-9-13-20(18)23-22(19)17-10-6-5-7-11-17/h5-13,23H,3-4,14-16H2,1-2H3
InChIKeyVEAFPKIMCGYMFZ-UHFFFAOYSA-N
MW334.46 g/mol
LogP5.03
Rot. Bonds7

About 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide

2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide (PubChem CID 10449567) has the molecular formula C22H26N2O and a molecular weight of 334.46 g/mol. Its IUPAC name is 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide
PubChem CID10449567
Molecular FormulaC22H26N2O
Molecular Weight334.46 g/mol
Exact Mass334.20
IUPAC Name2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C22H26N2O/c1-3-14-24(15-4-2)21(25)16-19-18-12-8-9-13-20(18)23-22(19)17-10-6-5-7-11-17/h5-13,23H,3-4,14-16H2,1-2H3
InChIKeyVEAFPKIMCGYMFZ-UHFFFAOYSA-N
XLogP5.03
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.46
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide 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 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide?
The IUPAC name of 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide (CID 10449567) is 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide.
What is the SMILES notation for 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide?
The canonical SMILES for 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide is CCCN(CCC)C(=O)Cc1c(-c2ccccc2)[nH]c2ccccc12.
What is the InChIKey of 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide?
The InChIKey is VEAFPKIMCGYMFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O/c1-3-14-24(15-4-2)21(25)16-19-18-12-8-9-13-20(18)23-22(19)17-10-6-5-7-11-17/h5-13,23H,3-4,14-16H2,1-2H3.
What are the key properties of 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide?
2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide has a molecular weight of 334.46 g/mol, XLogP of 5.03, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-1H-indol-3-yl)-N,N-dipropylacetamide is sourced from PubChem (CID 10449567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).