3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide

C21H24N2O2 — CID 18115503

IUPAC3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide
SMILESCCC(NC(=O)CCn1ccc2ccccc21)c1ccc(OC)cc1
InChIInChI=1S/C21H24N2O2/c1-3-19(16-8-10-18(25-2)11-9-16)22-21(24)13-15-23-14-12-17-6-4-5-7-20(17)23/h4-12,14,19H,3,13,15H2,1-2H3,(H,22,24)
InChIKeyBGZIGEPBKFRBDH-UHFFFAOYSA-N
MW336.44 g/mol
LogP4.31
Rot. Bonds7

About 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide

3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide (PubChem CID 18115503) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide.

Molecular Properties

Compound Name3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide
PubChem CID18115503
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide
SMILESCCC(NC(=O)CCn1ccc2ccccc21)c1ccc(OC)cc1
InChIInChI=1S/C21H24N2O2/c1-3-19(16-8-10-18(25-2)11-9-16)22-21(24)13-15-23-14-12-17-6-4-5-7-20(17)23/h4-12,14,19H,3,13,15H2,1-2H3,(H,22,24)
InChIKeyBGZIGEPBKFRBDH-UHFFFAOYSA-N
XLogP4.31
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide 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

3-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[1-(4-methoxyphenyl)propyl]propanamide
CID 18115505
3-indol-1-yl-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 55580848
3-(2,4-dioxoquinazolin-1-yl)-N-[1-(4-methoxyphenyl)propyl]propanamide
CID 24547729
N-[(1R)-1-(4-methoxyphenyl)propyl]-2-phenylacetamide
CID 28632525
N-[(1R)-1-(4-methoxyphenyl)propyl]-2-phenylsulfanylacetamide
CID 28958195
4-amino-N-[1-(4-methoxyphenyl)propyl]butanamide
CID 43708620
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[1-(4-methoxyphenyl)propyl]acetamide
CID 18121482
(2R,3S)-2-[3-(5-methoxyindol-1-yl)propanoylamino]-3-methylpentanoic acid
CID 124647642
N-[(1R)-1-(4-methoxyphenyl)propyl]-2-(4-methoxyphenyl)sulfanylacetamide
CID 28956181
N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide
CID 55371775
3-indol-1-yl-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]propanamide
CID 31002408
3-indol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]propanamide
CID 47018589

Frequently Asked Questions

What is the IUPAC name of 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide?
The IUPAC name of 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide (CID 18115503) is 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide.
What is the SMILES notation for 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide?
The canonical SMILES for 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide is CCC(NC(=O)CCn1ccc2ccccc21)c1ccc(OC)cc1.
What is the InChIKey of 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide?
The InChIKey is BGZIGEPBKFRBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c1-3-19(16-8-10-18(25-2)11-9-16)22-21(24)13-15-23-14-12-17-6-4-5-7-20(17)23/h4-12,14,19H,3,13,15H2,1-2H3,(H,22,24).
What are the key properties of 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide?
3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide has a molecular weight of 336.44 g/mol, XLogP of 4.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-indol-1-yl-N-[1-(4-methoxyphenyl)propyl]propanamide is sourced from PubChem (CID 18115503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).