N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine

C24H20F3N5 — CID 66961891

IUPACN-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine
SMILESFC(F)(F)CNC(c1cccnc1-c1cccnc1)C(c1cccnc1)c1cccnc1
InChIInChI=1S/C24H20F3N5/c25-24(26,27)16-32-23(20-8-4-12-31-22(20)19-7-3-11-30-15-19)21(17-5-1-9-28-13-17)18-6-2-10-29-14-18/h1-15,21,23,32H,16H2
InChIKeyBYSJEGPRLAWCKR-UHFFFAOYSA-N
MW435.45 g/mol
LogP4.96
Rot. Bonds7

About N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine

N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine (PubChem CID 66961891) has the molecular formula C24H20F3N5 and a molecular weight of 435.45 g/mol. Its IUPAC name is N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine.

Molecular Properties

Compound NameN-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine
PubChem CID66961891
Molecular FormulaC24H20F3N5
Molecular Weight435.45 g/mol
Exact Mass435.17
IUPAC NameN-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine
SMILESFC(F)(F)CNC(c1cccnc1-c1cccnc1)C(c1cccnc1)c1cccnc1
InChIInChI=1S/C24H20F3N5/c25-24(26,27)16-32-23(20-8-4-12-31-22(20)19-7-3-11-30-15-19)21(17-5-1-9-28-13-17)18-6-2-10-29-14-18/h1-15,21,23,32H,16H2
InChIKeyBYSJEGPRLAWCKR-UHFFFAOYSA-N
XLogP4.96
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.45
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

BC-1215
CID 72201045
Anabasamine
CID 161313
1-(1-Phenyl-2-(pyridin-2-yl)ethyl)piperazine
CID 44414862
Nemertelline
CID 3042423
4'-(4-Pyridyl)-2,2':6',2''-terpyridine
CID 11438308
2,6-Bis(2-pyridyl)-4-phenylpyridine
CID 4407216
2-phenyl-2-{5-[(E)-2-(pyridin-4-yl)ethenyl]pyridin-3-yl}ethan-1-amine
CID 23646979
3-{4-[5-(4-Fluoro-phenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]-piperidin-1-yl}-propylamine
CID 44399722
2-[[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]piperidin-1-yl]methyl]piperazine
CID 44453570
2-Phenyl-5-[(5-phenyl-3-pyridinyl)methyl]pyridine
CID 73356736
N-(2-pyridylmethyl)-1-[4-(4,10,17-triazabicyclo[11.3.1]heptadeca-1(17),13,15-trien-7-ylmethyl)phenyl]methanamine
CID 9889638
2,2':4',2''-Terpyridine, 6'-(2-pyridinyl)-
CID 9972674

Frequently Asked Questions

What is the IUPAC name of N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine?
The IUPAC name of N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine (CID 66961891) is N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine.
What is the SMILES notation for N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine?
The canonical SMILES for N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine is FC(F)(F)CNC(c1cccnc1-c1cccnc1)C(c1cccnc1)c1cccnc1.
What is the InChIKey of N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine?
The InChIKey is BYSJEGPRLAWCKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F3N5/c25-24(26,27)16-32-23(20-8-4-12-31-22(20)19-7-3-11-30-15-19)21(17-5-1-9-28-13-17)18-6-2-10-29-14-18/h1-15,21,23,32H,16H2.
What are the key properties of N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine?
N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine has a molecular weight of 435.45 g/mol, XLogP of 4.96, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dipyridin-3-yl-1-(2-pyridin-3-yl-3-pyridinyl)ethyl]-2,2,2-trifluoroethanamine is sourced from PubChem (CID 66961891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).