2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol

C14H18FNO — CID 117122777

IUPAC2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol
SMILESCC(CO)c1cc2ccc(F)cc2n1C(C)C
InChIInChI=1S/C14H18FNO/c1-9(2)16-13(10(3)8-17)6-11-4-5-12(15)7-14(11)16/h4-7,9-10,17H,8H2,1-3H3
InChIKeyZUTGDABAUKLIBJ-UHFFFAOYSA-N
MW235.30 g/mol
LogP3.46
Rot. Bonds3

About 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol

2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol (PubChem CID 117122777) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol
PubChem CID117122777
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol
SMILESCC(CO)c1cc2ccc(F)cc2n1C(C)C
InChIInChI=1S/C14H18FNO/c1-9(2)16-13(10(3)8-17)6-11-4-5-12(15)7-14(11)16/h4-7,9-10,17H,8H2,1-3H3
InChIKeyZUTGDABAUKLIBJ-UHFFFAOYSA-N
XLogP3.46
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol 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

2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-ol
CID 117122779
2-(6-fluoro-1-propan-2-ylindol-2-yl)propanoic acid
CID 117122852
6-fluoro-1-propan-2-ylindole-2-carbaldehyde
CID 117122831
2-(6-bromo-1-propan-2-ylindol-2-yl)propan-1-amine
CID 117122810
6-fluoro-2-[(4-methylpiperazin-1-yl)methyl]-1-propan-2-ylindole
CID 117180623
3-[(6-fluoro-1-propan-2-ylindol-2-yl)methoxy]phenol
CID 117180729
2-(5-fluoro-1-propan-2-ylindol-3-yl)propan-1-ol
CID 117121050
2-(5-fluoro-1-propan-2-ylindol-2-yl)acetic acid
CID 83860165
2-(5-fluoro-1-benzothiophen-2-yl)propan-1-ol
CID 117121247
1-(6-fluoroindol-1-yl)propan-2-ol
CID 10488020
2-(6-fluoro-1-benzothiophen-2-yl)propan-1-ol
CID 117122437
(2R)-2-(4-fluorophenyl)propan-1-ol
CID 12969934

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol?
The IUPAC name of 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol (CID 117122777) is 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol.
What is the SMILES notation for 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol?
The canonical SMILES for 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol is CC(CO)c1cc2ccc(F)cc2n1C(C)C.
What is the InChIKey of 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol?
The InChIKey is ZUTGDABAUKLIBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-9(2)16-13(10(3)8-17)6-11-4-5-12(15)7-14(11)16/h4-7,9-10,17H,8H2,1-3H3.
What are the key properties of 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol?
2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol has a molecular weight of 235.30 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-1-propan-2-ylindol-2-yl)propan-1-ol is sourced from PubChem (CID 117122777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).