3-(4-propoxyindol-1-yl)propan-1-amine

C14H20N2O — CID 83163339

IUPAC3-(4-propoxyindol-1-yl)propan-1-amine
SMILESCCCOc1cccc2c1ccn2CCCN
InChIInChI=1S/C14H20N2O/c1-2-11-17-14-6-3-5-13-12(14)7-10-16(13)9-4-8-15/h3,5-7,10H,2,4,8-9,11,15H2,1H3
InChIKeyIJOCZEZVGIWVMT-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.78
Rot. Bonds6

About 3-(4-propoxyindol-1-yl)propan-1-amine

3-(4-propoxyindol-1-yl)propan-1-amine (PubChem CID 83163339) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 3-(4-propoxyindol-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(4-propoxyindol-1-yl)propan-1-amine
PubChem CID83163339
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name3-(4-propoxyindol-1-yl)propan-1-amine
SMILESCCCOc1cccc2c1ccn2CCCN
InChIInChI=1S/C14H20N2O/c1-2-11-17-14-6-3-5-13-12(14)7-10-16(13)9-4-8-15/h3,5-7,10H,2,4,8-9,11,15H2,1H3
InChIKeyIJOCZEZVGIWVMT-UHFFFAOYSA-N
XLogP2.78
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-propoxyindol-1-yl)propan-1-amine 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

1-(3-ethoxypropyl)-4-propoxyindole
CID 83173539
4-propoxy-1-(2-propoxyethyl)indole
CID 106458022
1-(3-methylsulfonylpropyl)-4-propoxyindole
CID 83173638
3-(4-propoxyindol-1-yl)propanamide
CID 83173818
1-(2-ethylsulfonylethyl)-4-propoxyindole
CID 83174266
3-(4-propoxyindol-1-yl)propanoic acid
CID 83163575
3-(4-propoxyindol-1-yl)propanehydrazide
CID 83162357
N-methyl-3-(4-propoxyindol-1-yl)propanamide
CID 83174183
2-methyl-N-[2-(4-propoxyindol-1-yl)ethyl]butan-2-amine
CID 83164938
2-methyl-N-[2-(4-propoxyindol-1-yl)ethyl]propan-1-amine
CID 83163124
2-(4-propoxyindol-1-yl)acetohydrazide
CID 83163365
4-[(4-propoxyindol-1-yl)methyl]phenol
CID 83166122

Frequently Asked Questions

What is the IUPAC name of 3-(4-propoxyindol-1-yl)propan-1-amine?
The IUPAC name of 3-(4-propoxyindol-1-yl)propan-1-amine (CID 83163339) is 3-(4-propoxyindol-1-yl)propan-1-amine.
What is the SMILES notation for 3-(4-propoxyindol-1-yl)propan-1-amine?
The canonical SMILES for 3-(4-propoxyindol-1-yl)propan-1-amine is CCCOc1cccc2c1ccn2CCCN.
What is the InChIKey of 3-(4-propoxyindol-1-yl)propan-1-amine?
The InChIKey is IJOCZEZVGIWVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-11-17-14-6-3-5-13-12(14)7-10-16(13)9-4-8-15/h3,5-7,10H,2,4,8-9,11,15H2,1H3.
What are the key properties of 3-(4-propoxyindol-1-yl)propan-1-amine?
3-(4-propoxyindol-1-yl)propan-1-amine has a molecular weight of 232.33 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-propoxyindol-1-yl)propan-1-amine is sourced from PubChem (CID 83163339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).