3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide

C22H23N3O — CID 70207021

IUPAC3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide
SMILESCC(CNC(=O)CCc1c[nH]c2ccccc12)c1c[nH]c2ccccc12
InChIInChI=1S/C22H23N3O/c1-15(19-14-24-21-9-5-3-7-18(19)21)12-25-22(26)11-10-16-13-23-20-8-4-2-6-17(16)20/h2-9,13-15,23-24H,10-12H2,1H3,(H,25,26)
InChIKeyQGSSJXSXJZIGQI-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.50
Rot. Bonds6

About 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide

3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide (PubChem CID 70207021) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide
PubChem CID70207021
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide
SMILESCC(CNC(=O)CCc1c[nH]c2ccccc12)c1c[nH]c2ccccc12
InChIInChI=1S/C22H23N3O/c1-15(19-14-24-21-9-5-3-7-18(19)21)12-25-22(26)11-10-16-13-23-20-8-4-2-6-17(16)20/h2-9,13-15,23-24H,10-12H2,1H3,(H,25,26)
InChIKeyQGSSJXSXJZIGQI-UHFFFAOYSA-N
XLogP4.50
TPSA60.68 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-amino-3-hydroxybutyl)-3-(1H-indol-3-yl)propanamide
CID 64539569
N-(4-hydroxy-2-methylbutyl)-3-(1H-indol-3-yl)propanamide
CID 66109220
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
N-(2,3-dimethylbutyl)-4-(1H-indol-3-yl)butanamide
CID 64597246
3-(1H-indol-3-yl)-N-[(2R)-2-(4-methylpiperazin-1-yl)propyl]propanamide
CID 95604374
N-[2-(4-ethoxy-3-methoxyphenyl)-2-(1H-indol-3-yl)ethyl]-3-(1H-indol-3-yl)propanamide
CID 60606874
3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide
CID 17473957
N-hydroxy-3-(1H-indol-3-yl)propanamide
CID 23938574
1-(1H-indol-3-yl)-4-methylpentan-3-one
CID 154964513
4-(1H-indol-3-yl)-N-[2-[3-(1H-indol-3-yl)propanoylamino]ethyl]butanamide
CID 42506947
2-[3-(1H-indol-3-yl)propanoylamino]acetate
CID 7677841
N-[2-(furan-2-yl)-2-hydroxyethyl]-3-(1H-indol-3-yl)propanamide
CID 110889323

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide?
The IUPAC name of 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide (CID 70207021) is 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide?
The canonical SMILES for 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide is CC(CNC(=O)CCc1c[nH]c2ccccc12)c1c[nH]c2ccccc12.
What is the InChIKey of 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide?
The InChIKey is QGSSJXSXJZIGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-15(19-14-24-21-9-5-3-7-18(19)21)12-25-22(26)11-10-16-13-23-20-8-4-2-6-17(16)20/h2-9,13-15,23-24H,10-12H2,1H3,(H,25,26).
What are the key properties of 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide?
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide has a molecular weight of 345.45 g/mol, XLogP of 4.50, 6 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide is sourced from PubChem (CID 70207021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).