3-(2-aminopropyl)-1-propan-2-ylindol-4-ol

C14H20N2O — CID 83918695

IUPAC3-(2-aminopropyl)-1-propan-2-ylindol-4-ol
SMILESCC(N)Cc1cn(C(C)C)c2cccc(O)c12
InChIInChI=1S/C14H20N2O/c1-9(2)16-8-11(7-10(3)15)14-12(16)5-4-6-13(14)17/h4-6,8-10,17H,7,15H2,1-3H3
InChIKeyULFCQMVGMCMNBT-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.82
Rot. Bonds3

About 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol

3-(2-aminopropyl)-1-propan-2-ylindol-4-ol (PubChem CID 83918695) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol.

Molecular Properties

Compound Name3-(2-aminopropyl)-1-propan-2-ylindol-4-ol
PubChem CID83918695
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name3-(2-aminopropyl)-1-propan-2-ylindol-4-ol
SMILESCC(N)Cc1cn(C(C)C)c2cccc(O)c12
InChIInChI=1S/C14H20N2O/c1-9(2)16-8-11(7-10(3)15)14-12(16)5-4-6-13(14)17/h4-6,8-10,17H,7,15H2,1-3H3
InChIKeyULFCQMVGMCMNBT-UHFFFAOYSA-N
XLogP2.82
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol?
The IUPAC name of 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol (CID 83918695) is 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol.
What is the SMILES notation for 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol?
The canonical SMILES for 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol is CC(N)Cc1cn(C(C)C)c2cccc(O)c12.
What is the InChIKey of 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol?
The InChIKey is ULFCQMVGMCMNBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-9(2)16-8-11(7-10(3)15)14-12(16)5-4-6-13(14)17/h4-6,8-10,17H,7,15H2,1-3H3.
What are the key properties of 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol?
3-(2-aminopropyl)-1-propan-2-ylindol-4-ol has a molecular weight of 232.33 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminopropyl)-1-propan-2-ylindol-4-ol is sourced from PubChem (CID 83918695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).