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

C11H13FN2 — CID 55297904

IUPAC1-(5-fluoro-1H-indol-3-yl)propan-1-amine
SMILESCCC(N)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C11H13FN2/c1-2-10(13)9-6-14-11-4-3-7(12)5-8(9)11/h3-6,10,14H,2,13H2,1H3
InChIKeyGKJKPYVRXCGUCJ-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.72
Rot. Bonds2

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

1-(5-fluoro-1H-indol-3-yl)propan-1-amine (PubChem CID 55297904) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 1-(5-fluoro-1H-indol-3-yl)propan-1-amine.

Molecular Properties

Compound Name1-(5-fluoro-1H-indol-3-yl)propan-1-amine
PubChem CID55297904
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name1-(5-fluoro-1H-indol-3-yl)propan-1-amine
SMILESCCC(N)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C11H13FN2/c1-2-10(13)9-6-14-11-4-3-7(12)5-8(9)11/h3-6,10,14H,2,13H2,1H3
InChIKeyGKJKPYVRXCGUCJ-UHFFFAOYSA-N
XLogP2.72
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-(5-bromo-1H-indol-3-yl)propan-1-amine
CID 79015819
1-(5-fluoro-1H-indol-3-yl)propan-1-ol
CID 118499302
3-(5-fluoro-1H-indol-3-yl)pentan-1-amine
CID 57147957
3-amino-3-(5-fluoro-1H-indol-3-yl)propanoic acid
CID 82617027
2-(5-fluoro-1H-indol-3-yl)propan-1-amine
CID 13060
1-(5-fluoro-1H-indol-3-yl)butan-2-amine
CID 118713118
5-fluoro-3-(3-methylbutan-2-yl)-1H-indole
CID 106985153
(3S,4S)-3-amino-4-(5-fluoro-1H-indol-3-yl)pentan-2-one
CID 122607429
(1S)-1-(6-bromo-1H-indol-3-yl)propan-1-amine
CID 82758929
ethyl 4-amino-2-(5-fluoro-1H-indol-3-yl)butanoate
CID 57300309
2-(5-fluoro-1H-indol-3-yl)hexanoic acid
CID 67748915
2-(5-fluoro-1H-indol-3-yl)butanedinitrile
CID 71490951

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-1H-indol-3-yl)propan-1-amine?
The IUPAC name of 1-(5-fluoro-1H-indol-3-yl)propan-1-amine (CID 55297904) is 1-(5-fluoro-1H-indol-3-yl)propan-1-amine.
What is the SMILES notation for 1-(5-fluoro-1H-indol-3-yl)propan-1-amine?
The canonical SMILES for 1-(5-fluoro-1H-indol-3-yl)propan-1-amine is CCC(N)c1c[nH]c2ccc(F)cc12.
What is the InChIKey of 1-(5-fluoro-1H-indol-3-yl)propan-1-amine?
The InChIKey is GKJKPYVRXCGUCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-2-10(13)9-6-14-11-4-3-7(12)5-8(9)11/h3-6,10,14H,2,13H2,1H3.
What are the key properties of 1-(5-fluoro-1H-indol-3-yl)propan-1-amine?
1-(5-fluoro-1H-indol-3-yl)propan-1-amine has a molecular weight of 192.24 g/mol, XLogP of 2.72, 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-amine is sourced from PubChem (CID 55297904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).