6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine

C15H16F3N5 — CID 2741603

IUPAC6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine
SMILESNc1ccc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc1
InChIInChI=1S/C15H16F3N5/c16-15(17,18)11-1-3-13(20-9-11)22-5-7-23(8-6-22)14-4-2-12(19)10-21-14/h1-4,9-10H,5-8,19H2
InChIKeyQDZTWUCBEGLQEP-UHFFFAOYSA-N
MW323.32 g/mol
LogP2.40
Rot. Bonds2

About 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine

6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine (PubChem CID 2741603) has the molecular formula C15H16F3N5 and a molecular weight of 323.32 g/mol. Its IUPAC name is 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine
PubChem CID2741603
Molecular FormulaC15H16F3N5
Molecular Weight323.32 g/mol
Exact Mass323.14
IUPAC Name6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine
SMILESNc1ccc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc1
InChIInChI=1S/C15H16F3N5/c16-15(17,18)11-1-3-13(20-9-11)22-5-7-23(8-6-22)14-4-2-12(19)10-21-14/h1-4,9-10H,5-8,19H2
InChIKeyQDZTWUCBEGLQEP-UHFFFAOYSA-N
XLogP2.40
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine
CID 829355
3-piperidin-1-yl-6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine
CID 165433334
1-(4-fluorophenyl)-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine
CID 3702315
[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]azanium
CID 28873857
1-[4-(5-amino-2-pyridinyl)piperazin-1-yl]-3,3,3-trifluoropropan-1-one
CID 43462000
3-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propanamide
CID 38559713
1-[5-(trifluoromethyl)-2-pyridinyl]azetidin-3-amine;dihydrochloride
CID 91623900
1-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepane
CID 2760779
2,2,2-trifluoroethyl 4-[5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxylate
CID 47085107
1-(3-chloro-4-pyridinyl)-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine
CID 133352551
[4-(trifluoromethyl)phenyl]-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methanone
CID 27809741
4-[6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 122282533

Frequently Asked Questions

What is the IUPAC name of 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine?
The IUPAC name of 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine (CID 2741603) is 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine.
What is the SMILES notation for 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine?
The canonical SMILES for 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine is Nc1ccc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc1.
What is the InChIKey of 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine?
The InChIKey is QDZTWUCBEGLQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N5/c16-15(17,18)11-1-3-13(20-9-11)22-5-7-23(8-6-22)14-4-2-12(19)10-21-14/h1-4,9-10H,5-8,19H2.
What are the key properties of 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine?
6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine has a molecular weight of 323.32 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridin-3-amine is sourced from PubChem (CID 2741603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).