[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine

C15H14FN3 — CID 115114192

IUPAC[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine
SMILESCn1cc(-c2cc(CN)ccn2)c2c(F)cccc21
InChIInChI=1S/C15H14FN3/c1-19-9-11(13-7-10(8-17)5-6-18-13)15-12(16)3-2-4-14(15)19/h2-7,9H,8,17H2,1H3
InChIKeyHOOQZDFHLSPGJA-UHFFFAOYSA-N
MW255.30 g/mol
LogP2.84
Rot. Bonds2

About [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine

[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine (PubChem CID 115114192) has the molecular formula C15H14FN3 and a molecular weight of 255.30 g/mol. Its IUPAC name is [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine
PubChem CID115114192
Molecular FormulaC15H14FN3
Molecular Weight255.30 g/mol
Exact Mass255.12
IUPAC Name[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine
SMILESCn1cc(-c2cc(CN)ccn2)c2c(F)cccc21
InChIInChI=1S/C15H14FN3/c1-19-9-11(13-7-10(8-17)5-6-18-13)15-12(16)3-2-4-14(15)19/h2-7,9H,8,17H2,1H3
InChIKeyHOOQZDFHLSPGJA-UHFFFAOYSA-N
XLogP2.84
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.30
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(1-methylindol-3-yl)-4-pyridinyl]methanamine
CID 115114062
[2-(1,6-dimethylindol-3-yl)-4-pyridinyl]methanamine
CID 115114104
[2-(6-methoxy-1-methylindol-3-yl)-4-pyridinyl]methanamine
CID 115114129
[2-(2-fluoro-3-methylphenyl)-4-pyridinyl]methanamine;dihydrochloride
CID 171365578
6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline
CID 18729693
[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine
CID 115113748
[2-[1-methyl-4-(trifluoromethyl)indol-2-yl]-4-pyridinyl]methanamine
CID 115114017
[2-(2-chlorophenyl)-4-pyridinyl]methanamine
CID 83706166
[2-(3-fluorophenyl)-4-pyridinyl]methanamine;dihydrochloride
CID 171365586
5-(4-fluoro-1-methylindol-3-yl)-1-methylpyrazole-3-carboxylic acid
CID 115108326
[6-(1-methylindol-3-yl)pyrimidin-4-yl]methanamine
CID 116857550
2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine
CID 115114118

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine?
The IUPAC name of [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine (CID 115114192) is [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine?
The canonical SMILES for [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine is Cn1cc(-c2cc(CN)ccn2)c2c(F)cccc21.
What is the InChIKey of [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine?
The InChIKey is HOOQZDFHLSPGJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3/c1-19-9-11(13-7-10(8-17)5-6-18-13)15-12(16)3-2-4-14(15)19/h2-7,9H,8,17H2,1H3.
What are the key properties of [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine?
[2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine has a molecular weight of 255.30 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluoro-1-methylindol-3-yl)-4-pyridinyl]methanamine is sourced from PubChem (CID 115114192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).