5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine

C15H14FN3 — CID 118293001

IUPAC5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ccc(-c2c[nH]c3cc(F)ccc23)cn1
InChIInChI=1S/C15H14FN3/c1-19(2)15-6-3-10(8-18-15)13-9-17-14-7-11(16)4-5-12(13)14/h3-9,17H,1-2H3
InChIKeyCUZOMSRCCMSCGW-UHFFFAOYSA-N
MW255.30 g/mol
LogP3.43
Rot. Bonds2

About 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine

5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine (PubChem CID 118293001) has the molecular formula C15H14FN3 and a molecular weight of 255.30 g/mol. Its IUPAC name is 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine
PubChem CID118293001
Molecular FormulaC15H14FN3
Molecular Weight255.30 g/mol
Exact Mass255.12
IUPAC Name5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ccc(-c2c[nH]c3cc(F)ccc23)cn1
InChIInChI=1S/C15H14FN3/c1-19(2)15-6-3-10(8-18-15)13-9-17-14-7-11(16)4-5-12(13)14/h3-9,17H,1-2H3
InChIKeyCUZOMSRCCMSCGW-UHFFFAOYSA-N
XLogP3.43
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.30
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine (CID 118293001) is 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine is CN(C)c1ccc(-c2c[nH]c3cc(F)ccc23)cn1.
What is the InChIKey of 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine?
The InChIKey is CUZOMSRCCMSCGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3/c1-19(2)15-6-3-10(8-18-15)13-9-17-14-7-11(16)4-5-12(13)14/h3-9,17H,1-2H3.
What are the key properties of 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine?
5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine has a molecular weight of 255.30 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-fluoro-1H-indol-3-yl)-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 118293001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).