2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine

C11H13FN2 — CID 82604676

IUPAC2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine
SMILESCNCCc1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C11H13FN2/c1-13-5-4-10-7-8-6-9(12)2-3-11(8)14-10/h2-3,6-7,13-14H,4-5H2,1H3
InChIKeyKCRZLBHZMIREEY-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.07
Rot. Bonds3

About 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine

2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine (PubChem CID 82604676) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine
PubChem CID82604676
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine
SMILESCNCCc1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C11H13FN2/c1-13-5-4-10-7-8-6-9(12)2-3-11(8)14-10/h2-3,6-7,13-14H,4-5H2,1H3
InChIKeyKCRZLBHZMIREEY-UHFFFAOYSA-N
XLogP2.07
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

5-fluoro-2-(2-methylpropyl)-1H-indole
CID 177351441
1-(5-fluoro-1H-indol-2-yl)-N-methylmethanamine;methanesulfonic acid
CID 53398780
methyl 3-(5-fluoro-1H-indol-2-yl)propanoate
CID 68676585
1-(5-fluoro-1H-indol-2-yl)propan-2-amine
CID 10058400
N-methyl-3-[5-(trifluoromethyl)-1H-indol-2-yl]propan-1-amine
CID 117195108
1-(5-fluoro-1H-indol-2-yl)butan-2-amine
CID 131338781
1-(5-fluoro-1H-indol-2-yl)-2-methylpropan-2-ol
CID 117195228
1-(5-fluoro-1H-indol-2-yl)-2-(methylamino)ethanone
CID 82396041
5-fluoro-2-(propan-2-ylsulfanylmethyl)-1H-indole
CID 117176864
5-fluoro-2-pentyl-1H-indole;3,3,3-trifluoroprop-1-ene
CID 159912969
3-(5-fluoro-1H-indol-2-yl)-2,2-dimethylpropanoic acid
CID 117195248
2-[2-(methylamino)ethyl]-1H-indole-4,5-diol
CID 71291425

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine?
The IUPAC name of 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine (CID 82604676) is 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine is CNCCc1cc2cc(F)ccc2[nH]1.
What is the InChIKey of 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine?
The InChIKey is KCRZLBHZMIREEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-13-5-4-10-7-8-6-9(12)2-3-11(8)14-10/h2-3,6-7,13-14H,4-5H2,1H3.
What are the key properties of 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine?
2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine has a molecular weight of 192.24 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-1H-indol-2-yl)-N-methylethanamine is sourced from PubChem (CID 82604676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).