1-(5-fluoro-1H-indol-3-yl)propan-1-ol

C11H12FNO — CID 118499302

IUPAC1-(5-fluoro-1H-indol-3-yl)propan-1-ol
SMILESCCC(O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C11H12FNO/c1-2-11(14)9-6-13-10-4-3-7(12)5-8(9)10/h3-6,11,13-14H,2H2,1H3
InChIKeyKBMAIXAWEKHPKE-UHFFFAOYSA-N
MW193.22 g/mol
LogP2.75
Rot. Bonds2

About 1-(5-fluoro-1H-indol-3-yl)propan-1-ol

1-(5-fluoro-1H-indol-3-yl)propan-1-ol (PubChem CID 118499302) has the molecular formula C11H12FNO and a molecular weight of 193.22 g/mol. Its IUPAC name is 1-(5-fluoro-1H-indol-3-yl)propan-1-ol.

Molecular Properties

Compound Name1-(5-fluoro-1H-indol-3-yl)propan-1-ol
PubChem CID118499302
Molecular FormulaC11H12FNO
Molecular Weight193.22 g/mol
Exact Mass193.09
IUPAC Name1-(5-fluoro-1H-indol-3-yl)propan-1-ol
SMILESCCC(O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C11H12FNO/c1-2-11(14)9-6-13-10-4-3-7(12)5-8(9)10/h3-6,11,13-14H,2H2,1H3
InChIKeyKBMAIXAWEKHPKE-UHFFFAOYSA-N
XLogP2.75
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5-fluoro-1H-indol-3-yl)propan-1-amine
CID 55297904
(1S)-1-(5-chloro-1H-indol-3-yl)propan-1-ol
CID 82758549
3-(5-fluoro-1H-indol-3-yl)pentan-1-amine
CID 57147957
5-fluoro-3-(3-methylbutan-2-yl)-1H-indole
CID 106985153
1-(5-fluoro-1H-indol-3-yl)prop-2-en-1-ol
CID 68783636
2-(5-fluoro-1H-indol-3-yl)propan-1-amine
CID 13060
(1R)-1-(5-fluoro-1H-indol-3-yl)-2-[4-(4-fluorophenyl)piperazin-1-yl]ethanol
CID 92736475
(1R)-1-(6-methyl-1H-indol-3-yl)propan-1-ol
CID 82758344
(1S)-1-(6-methyl-1H-indol-3-yl)propan-1-ol
CID 82758444
2-(5-fluoro-1H-indol-3-yl)hexanoic acid
CID 67748915
ethyl 4-amino-2-(5-fluoro-1H-indol-3-yl)butanoate
CID 57300309
3-amino-3-(5-fluoro-1H-indol-3-yl)propanoic acid
CID 82617027

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-1H-indol-3-yl)propan-1-ol?
The IUPAC name of 1-(5-fluoro-1H-indol-3-yl)propan-1-ol (CID 118499302) is 1-(5-fluoro-1H-indol-3-yl)propan-1-ol.
What is the SMILES notation for 1-(5-fluoro-1H-indol-3-yl)propan-1-ol?
The canonical SMILES for 1-(5-fluoro-1H-indol-3-yl)propan-1-ol is CCC(O)c1c[nH]c2ccc(F)cc12.
What is the InChIKey of 1-(5-fluoro-1H-indol-3-yl)propan-1-ol?
The InChIKey is KBMAIXAWEKHPKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO/c1-2-11(14)9-6-13-10-4-3-7(12)5-8(9)10/h3-6,11,13-14H,2H2,1H3.
What are the key properties of 1-(5-fluoro-1H-indol-3-yl)propan-1-ol?
1-(5-fluoro-1H-indol-3-yl)propan-1-ol has a molecular weight of 193.22 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-1H-indol-3-yl)propan-1-ol is sourced from PubChem (CID 118499302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).