(1-ethyl-7-fluoroindol-3-yl)methanamine

C11H13FN2 — CID 117182293

IUPAC(1-ethyl-7-fluoroindol-3-yl)methanamine
SMILESCCn1cc(CN)c2cccc(F)c21
InChIInChI=1S/C11H13FN2/c1-2-14-7-8(6-13)9-4-3-5-10(12)11(9)14/h3-5,7H,2,6,13H2,1H3
InChIKeyGMRIVMIRPQHMDH-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.26
Rot. Bonds2

About (1-ethyl-7-fluoroindol-3-yl)methanamine

(1-ethyl-7-fluoroindol-3-yl)methanamine (PubChem CID 117182293) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is (1-ethyl-7-fluoroindol-3-yl)methanamine.

Molecular Properties

Compound Name(1-ethyl-7-fluoroindol-3-yl)methanamine
PubChem CID117182293
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name(1-ethyl-7-fluoroindol-3-yl)methanamine
SMILESCCn1cc(CN)c2cccc(F)c21
InChIInChI=1S/C11H13FN2/c1-2-14-7-8(6-13)9-4-3-5-10(12)11(9)14/h3-5,7H,2,6,13H2,1H3
InChIKeyGMRIVMIRPQHMDH-UHFFFAOYSA-N
XLogP2.26
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-ethyl-7-fluoroindol-3-yl)propan-1-ol
CID 83967143
[1-ethyl-3-[(4-fluorophenoxy)methyl]indol-7-yl]methanamine
CID 117182232
3-(1-ethyl-7-methylindol-3-yl)propan-1-amine
CID 117197455
1-ethyl-3-(hydroxymethyl)indol-7-ol
CID 117182594
2-(1-ethyl-7-fluoroindol-3-yl)-2-methylpropanoic acid
CID 117197726
3-(1-ethyl-7-methoxyindol-3-yl)propan-1-amine
CID 117197959
(1-ethylpyrrolo[2,3-b]pyridin-3-yl)methanamine
CID 66414119
[1-ethyl-3-[(2-methylphenoxy)methyl]indol-7-yl]methanamine
CID 117182214
(7-chloro-1-ethylindol-3-yl)methanol
CID 83522863
3-(7-fluoro-1-methylindol-3-yl)-2-methylpropan-1-amine
CID 83860070
(7-fluoro-1-methylindol-3-yl)methanethiol
CID 117182099
3-(ethylsulfanylmethyl)-7-fluoro-1-methylindole
CID 117182069

Frequently Asked Questions

What is the IUPAC name of (1-ethyl-7-fluoroindol-3-yl)methanamine?
The IUPAC name of (1-ethyl-7-fluoroindol-3-yl)methanamine (CID 117182293) is (1-ethyl-7-fluoroindol-3-yl)methanamine.
What is the SMILES notation for (1-ethyl-7-fluoroindol-3-yl)methanamine?
The canonical SMILES for (1-ethyl-7-fluoroindol-3-yl)methanamine is CCn1cc(CN)c2cccc(F)c21.
What is the InChIKey of (1-ethyl-7-fluoroindol-3-yl)methanamine?
The InChIKey is GMRIVMIRPQHMDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-2-14-7-8(6-13)9-4-3-5-10(12)11(9)14/h3-5,7H,2,6,13H2,1H3.
What are the key properties of (1-ethyl-7-fluoroindol-3-yl)methanamine?
(1-ethyl-7-fluoroindol-3-yl)methanamine has a molecular weight of 192.24 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-7-fluoroindol-3-yl)methanamine is sourced from PubChem (CID 117182293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).