2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine

C14H12FN3 — CID 115114118

IUPAC2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine
SMILESCn1cc(-c2cc(N)ccn2)c2ccc(F)cc21
InChIInChI=1S/C14H12FN3/c1-18-8-12(13-7-10(16)4-5-17-13)11-3-2-9(15)6-14(11)18/h2-8H,1H3,(H2,16,17)
InChIKeyBGZUVCPBTABAOW-UHFFFAOYSA-N
MW241.27 g/mol
LogP2.96
Rot. Bonds1

About 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine

2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine (PubChem CID 115114118) has the molecular formula C14H12FN3 and a molecular weight of 241.27 g/mol. Its IUPAC name is 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine.

Molecular Properties

Compound Name2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine
PubChem CID115114118
Molecular FormulaC14H12FN3
Molecular Weight241.27 g/mol
Exact Mass241.10
IUPAC Name2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine
SMILESCn1cc(-c2cc(N)ccn2)c2ccc(F)cc21
InChIInChI=1S/C14H12FN3/c1-18-8-12(13-7-10(16)4-5-17-13)11-3-2-9(15)6-14(11)18/h2-8H,1H3,(H2,16,17)
InChIKeyBGZUVCPBTABAOW-UHFFFAOYSA-N
XLogP2.96
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-bromo-1-methylindol-3-yl)pyridin-4-amine
CID 115114160
[2-(1,6-dimethylindol-3-yl)-4-pyridinyl]methanamine
CID 115114104
[2-(6-methoxy-1-methylindol-3-yl)-4-pyridinyl]methanamine
CID 115114129
2-(6-hydroxy-1-methylindol-3-yl)pyridine-4-carboxylic acid
CID 115114136
[2-(1-methylindol-3-yl)-4-pyridinyl]methanamine
CID 115114062
6-fluoro-1-methyl-3-propan-2-ylindole
CID 58525499
3-chloro-6-fluoro-1-methylindole
CID 153370485
3-(5-fluoro-1-methylindol-3-yl)-1,2-oxazole-5-carboxylic acid
CID 115108431
tris(2-(4-amino-2-pyridinyl)pyridin-4-amine);ruthenium(2+);dichloride
CID 154703049
3-(2-chloropyrimidin-4-yl)-1-methylindole-6-carbonitrile
CID 118903794
4-(5-fluoro-1-propan-2-ylindol-3-yl)pyrimidin-2-amine
CID 16752480
3-(2-tert-butylpyrimidin-4-yl)-1,6-dimethylindole
CID 173339595

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine?
The IUPAC name of 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine (CID 115114118) is 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine.
What is the SMILES notation for 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine?
The canonical SMILES for 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine is Cn1cc(-c2cc(N)ccn2)c2ccc(F)cc21.
What is the InChIKey of 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine?
The InChIKey is BGZUVCPBTABAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3/c1-18-8-12(13-7-10(16)4-5-17-13)11-3-2-9(15)6-14(11)18/h2-8H,1H3,(H2,16,17).
What are the key properties of 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine?
2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine has a molecular weight of 241.27 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-1-methylindol-3-yl)pyridin-4-amine is sourced from PubChem (CID 115114118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).