3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine

C19H19F3N4 — CID 53493779

IUPAC3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine
SMILESFC(F)(F)c1ccc(Nc2ccc3c(C4CCNCC4)c[nH]c3c2)cn1
InChIInChI=1S/C19H19F3N4/c20-19(21,22)18-4-2-14(10-25-18)26-13-1-3-15-16(11-24-17(15)9-13)12-5-7-23-8-6-12/h1-4,9-12,23-24,26H,5-8H2
InChIKeyOHKNLFDNNMGDOH-UHFFFAOYSA-N
MW360.38 g/mol
LogP4.79
Rot. Bonds3

About 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine

3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine (PubChem CID 53493779) has the molecular formula C19H19F3N4 and a molecular weight of 360.38 g/mol. Its IUPAC name is 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine.

Molecular Properties

Compound Name3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine
PubChem CID53493779
Molecular FormulaC19H19F3N4
Molecular Weight360.38 g/mol
Exact Mass360.16
IUPAC Name3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine
SMILESFC(F)(F)c1ccc(Nc2ccc3c(C4CCNCC4)c[nH]c3c2)cn1
InChIInChI=1S/C19H19F3N4/c20-19(21,22)18-4-2-14(10-25-18)26-13-1-3-15-16(11-24-17(15)9-13)12-5-7-23-8-6-12/h1-4,9-12,23-24,26H,5-8H2
InChIKeyOHKNLFDNNMGDOH-UHFFFAOYSA-N
XLogP4.79
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.38
LogP ≤ 54.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine?
The IUPAC name of 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine (CID 53493779) is 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine.
What is the SMILES notation for 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine?
The canonical SMILES for 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine is FC(F)(F)c1ccc(Nc2ccc3c(C4CCNCC4)c[nH]c3c2)cn1.
What is the InChIKey of 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine?
The InChIKey is OHKNLFDNNMGDOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N4/c20-19(21,22)18-4-2-14(10-25-18)26-13-1-3-15-16(11-24-17(15)9-13)12-5-7-23-8-6-12/h1-4,9-12,23-24,26H,5-8H2.
What are the key properties of 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine?
3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine has a molecular weight of 360.38 g/mol, XLogP of 4.79, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine is sourced from PubChem (CID 53493779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).