2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine

C16H18FN3 — CID 103494389

IUPAC2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine
SMILESCc1ccncc1C(CN)N1CCc2ccc(F)cc21
InChIInChI=1S/C16H18FN3/c1-11-4-6-19-10-14(11)16(9-18)20-7-5-12-2-3-13(17)8-15(12)20/h2-4,6,8,10,16H,5,7,9,18H2,1H3
InChIKeyGVSSHPAYNLJILV-UHFFFAOYSA-N
MW271.34 g/mol
LogP2.59
Rot. Bonds3

About 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine

2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine (PubChem CID 103494389) has the molecular formula C16H18FN3 and a molecular weight of 271.34 g/mol. Its IUPAC name is 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine
PubChem CID103494389
Molecular FormulaC16H18FN3
Molecular Weight271.34 g/mol
Exact Mass271.15
IUPAC Name2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine
SMILESCc1ccncc1C(CN)N1CCc2ccc(F)cc21
InChIInChI=1S/C16H18FN3/c1-11-4-6-19-10-14(11)16(9-18)20-7-5-12-2-3-13(17)8-15(12)20/h2-4,6,8,10,16H,5,7,9,18H2,1H3
InChIKeyGVSSHPAYNLJILV-UHFFFAOYSA-N
XLogP2.59
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,3-dimethylpyrazol-4-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494548
2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494477
2-(3-chloro-5-fluorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494431
2-(3-bromofuran-2-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 106885883
2-(4,5-dibromofuran-2-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494492
3-amino-2-(6-fluoro-2,3-dihydroindol-1-yl)propanoic acid
CID 103494512
2-(6-fluoro-2,3-dihydroindol-1-yl)-5-methylsulfanylpentan-1-amine
CID 103494475
2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494523
2-(6-fluoro-2,3-dihydroindol-1-yl)-N-methyl-2-phenylethanamine
CID 103503159
3-(6-fluoro-2,3-dihydroindol-1-yl)-2-methylbutanoic acid
CID 103498081
2-(6-fluoro-2,3-dihydroindol-1-yl)propanoic acid
CID 103827394
2-(4-bromo-2-fluorophenyl)-2-(2,3-dihydroindol-1-yl)ethanamine
CID 43173934

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine (CID 103494389) is 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine is Cc1ccncc1C(CN)N1CCc2ccc(F)cc21.
What is the InChIKey of 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine?
The InChIKey is GVSSHPAYNLJILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3/c1-11-4-6-19-10-14(11)16(9-18)20-7-5-12-2-3-13(17)8-15(12)20/h2-4,6,8,10,16H,5,7,9,18H2,1H3.
What are the key properties of 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine?
2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine has a molecular weight of 271.34 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 103494389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).