N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine

C15H17FN4 — CID 103502851

IUPACN-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cncc(N2CCc3ccc(F)cc32)n1
InChIInChI=1S/C15H17FN4/c1-2-17-8-13-9-18-10-15(19-13)20-6-5-11-3-4-12(16)7-14(11)20/h3-4,7,9-10,17H,2,5-6,8H2,1H3
InChIKeyWYJIMNFMLHXGCV-UHFFFAOYSA-N
MW272.33 g/mol
LogP2.42
Rot. Bonds4

About N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine

N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine (PubChem CID 103502851) has the molecular formula C15H17FN4 and a molecular weight of 272.33 g/mol. Its IUPAC name is N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine
PubChem CID103502851
Molecular FormulaC15H17FN4
Molecular Weight272.33 g/mol
Exact Mass272.14
IUPAC NameN-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cncc(N2CCc3ccc(F)cc32)n1
InChIInChI=1S/C15H17FN4/c1-2-17-8-13-9-18-10-15(19-13)20-6-5-11-3-4-12(16)7-14(11)20/h3-4,7,9-10,17H,2,5-6,8H2,1H3
InChIKeyWYJIMNFMLHXGCV-UHFFFAOYSA-N
XLogP2.42
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[6-(3,4-dihydro-2H-quinolin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 66456379
N-[[3-chloro-6-(6-fluoro-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]ethanamine
CID 103502907
N-[[2-(6-fluoro-2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]ethanamine
CID 103502844
N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 103502859
N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 103499268
6-(6-fluoro-2,3-dihydroindol-1-yl)-4-N-propylpyrimidine-2,4-diamine
CID 103504467
6-(6-fluoro-2,3-dihydroindol-1-yl)-2-propylpyrimidin-4-amine
CID 103504469
[2-(6-fluoro-2,3-dihydroindol-1-yl)-6-methyl-4-pyridinyl]methanol
CID 103501402
[6-(6-fluoro-2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]methanol
CID 103501395
N-[[1-[2-(6-fluoro-2,3-dihydroindol-1-yl)ethyl]triazol-4-yl]methyl]ethanamine
CID 103503117
[6-(6-fluoro-2,3-dihydroindol-1-yl)-3-pyridinyl]methanol
CID 103498498
N-[[6-(3,6-dihydro-2H-pyridin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 114412543

Frequently Asked Questions

What is the IUPAC name of N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine?
The IUPAC name of N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine (CID 103502851) is N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine is CCNCc1cncc(N2CCc3ccc(F)cc32)n1.
What is the InChIKey of N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine?
The InChIKey is WYJIMNFMLHXGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4/c1-2-17-8-13-9-18-10-15(19-13)20-6-5-11-3-4-12(16)7-14(11)20/h3-4,7,9-10,17H,2,5-6,8H2,1H3.
What are the key properties of N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine?
N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine has a molecular weight of 272.33 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(6-fluoro-2,3-dihydroindol-1-yl)pyrazin-2-yl]methyl]ethanamine is sourced from PubChem (CID 103502851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).