1-(1-ethylindol-6-yl)propan-2-ol

C13H17NO — CID 115106620

IUPAC1-(1-ethylindol-6-yl)propan-2-ol
SMILESCCn1ccc2ccc(CC(C)O)cc21
InChIInChI=1S/C13H17NO/c1-3-14-7-6-12-5-4-11(8-10(2)15)9-13(12)14/h4-7,9-10,15H,3,8H2,1-2H3
InChIKeyIZBPBXKZMYZJPY-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.58
Rot. Bonds3

About 1-(1-ethylindol-6-yl)propan-2-ol

1-(1-ethylindol-6-yl)propan-2-ol (PubChem CID 115106620) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 1-(1-ethylindol-6-yl)propan-2-ol.

Molecular Properties

Compound Name1-(1-ethylindol-6-yl)propan-2-ol
PubChem CID115106620
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name1-(1-ethylindol-6-yl)propan-2-ol
SMILESCCn1ccc2ccc(CC(C)O)cc21
InChIInChI=1S/C13H17NO/c1-3-14-7-6-12-5-4-11(8-10(2)15)9-13(12)14/h4-7,9-10,15H,3,8H2,1-2H3
InChIKeyIZBPBXKZMYZJPY-UHFFFAOYSA-N
XLogP2.58
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(1-ethylindol-6-yl)propan-2-ol 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 1-(1-ethylindol-6-yl)propan-2-ol?
The IUPAC name of 1-(1-ethylindol-6-yl)propan-2-ol (CID 115106620) is 1-(1-ethylindol-6-yl)propan-2-ol.
What is the SMILES notation for 1-(1-ethylindol-6-yl)propan-2-ol?
The canonical SMILES for 1-(1-ethylindol-6-yl)propan-2-ol is CCn1ccc2ccc(CC(C)O)cc21.
What is the InChIKey of 1-(1-ethylindol-6-yl)propan-2-ol?
The InChIKey is IZBPBXKZMYZJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-3-14-7-6-12-5-4-11(8-10(2)15)9-13(12)14/h4-7,9-10,15H,3,8H2,1-2H3.
What are the key properties of 1-(1-ethylindol-6-yl)propan-2-ol?
1-(1-ethylindol-6-yl)propan-2-ol has a molecular weight of 203.28 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylindol-6-yl)propan-2-ol is sourced from PubChem (CID 115106620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).