2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride

C11H14ClFN2 — CID 135381436

IUPAC2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride
SMILESCl.Cn1ccc2cc(CCN)c(F)cc21
InChIInChI=1S/C11H13FN2.ClH/c1-14-5-3-9-6-8(2-4-13)10(12)7-11(9)14;/h3,5-7H,2,4,13H2,1H3;1H
InChIKeyFJIAXKIGHCXYLV-UHFFFAOYSA-N
MW228.70 g/mol
LogP2.24
Rot. Bonds2

About 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride

2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride (PubChem CID 135381436) has the molecular formula C11H14ClFN2 and a molecular weight of 228.70 g/mol. Its IUPAC name is 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride
PubChem CID135381436
Molecular FormulaC11H14ClFN2
Molecular Weight228.70 g/mol
Exact Mass228.08
IUPAC Name2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride
SMILESCl.Cn1ccc2cc(CCN)c(F)cc21
InChIInChI=1S/C11H13FN2.ClH/c1-14-5-3-9-6-8(2-4-13)10(12)7-11(9)14;/h3,5-7H,2,4,13H2,1H3;1H
InChIKeyFJIAXKIGHCXYLV-UHFFFAOYSA-N
XLogP2.24
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.70
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride (CID 135381436) is 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride is Cl.Cn1ccc2cc(CCN)c(F)cc21.
What is the InChIKey of 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride?
The InChIKey is FJIAXKIGHCXYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2.ClH/c1-14-5-3-9-6-8(2-4-13)10(12)7-11(9)14;/h3,5-7H,2,4,13H2,1H3;1H.
What are the key properties of 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride?
2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride has a molecular weight of 228.70 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-1-methylindol-5-yl)ethanamine;hydrochloride is sourced from PubChem (CID 135381436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).