2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine

C11H13FN2 — CID 15274380

IUPAC2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine
SMILESCc1ccc2[nH]cc(CCN)c2c1F
InChIInChI=1S/C11H13FN2/c1-7-2-3-9-10(11(7)12)8(4-5-13)6-14-9/h2-3,6,14H,4-5,13H2,1H3
InChIKeyNVIMBYDPIKMMNX-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.12
Rot. Bonds2

About 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine

2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine (PubChem CID 15274380) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine
PubChem CID15274380
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine
SMILESCc1ccc2[nH]cc(CCN)c2c1F
InChIInChI=1S/C11H13FN2/c1-7-2-3-9-10(11(7)12)8(4-5-13)6-14-9/h2-3,6,14H,4-5,13H2,1H3
InChIKeyNVIMBYDPIKMMNX-UHFFFAOYSA-N
XLogP2.12
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 ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4,7-dimethyl-1H-indol-3-yl)ethanamine;hydrochloride
CID 18702258
1-(2-aminoethyl)-9-methyl-3H-pyrano[3,2-e]indol-7-one
CID 24994402
N-[2-(4,5-difluoro-1H-indol-3-yl)ethyl]acetamide
CID 162744824
2-(4-chloro-5-methoxy-1H-indol-3-yl)ethanamine
CID 23373069
4,5-dimethyl-3-pentyl-1H-indole
CID 168931300
2-(4-bromo-5-propoxy-1H-indol-3-yl)ethanamine
CID 23373042
3-ethyl-4-fluoro-5-iodo-1H-indole
CID 166610518
2-(4-fluoro-5-methoxy-1H-indol-3-yl)-N,N-dimethylethanamine
CID 10082834
2-(6-fluoro-1H-indol-3-yl)ethanamine;hydron
CID 121393685
3-(2-aminoethyl)-N,N-dimethyl-1H-indol-5-amine;methane;hydrochloride
CID 20976500
1-(2-aminoethyl)-3,7,8,9-tetrahydropyrrolo[3,2-f]isoquinolin-6-one
CID 24764972
2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine
CID 71510843

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine?
The IUPAC name of 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine (CID 15274380) is 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine.
What is the SMILES notation for 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine?
The canonical SMILES for 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine is Cc1ccc2[nH]cc(CCN)c2c1F.
What is the InChIKey of 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine?
The InChIKey is NVIMBYDPIKMMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-7-2-3-9-10(11(7)12)8(4-5-13)6-14-9/h2-3,6,14H,4-5,13H2,1H3.
What are the key properties of 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine?
2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine has a molecular weight of 192.24 g/mol, XLogP of 2.12, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-5-methyl-1H-indol-3-yl)ethanamine is sourced from PubChem (CID 15274380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).