N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine

C20H20F3N7 — CID 145445505

IUPACN-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine
SMILESCc1cc(Nc2nc(-c3cccc(C(F)(F)F)n3)nc(C3CCCCN3)n2)ccn1
InChIInChI=1S/C20H20F3N7/c1-12-11-13(8-10-24-12)26-19-29-17(14-5-2-3-9-25-14)28-18(30-19)15-6-4-7-16(27-15)20(21,22)23/h4,6-8,10-11,14,25H,2-3,5,9H2,1H3,(H,24,26,28,29,30)
InChIKeyOCKHKBHTCKIMBH-UHFFFAOYSA-N
MW415.42 g/mol
LogP4.21
Rot. Bonds4

About N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine

N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine (PubChem CID 145445505) has the molecular formula C20H20F3N7 and a molecular weight of 415.42 g/mol. Its IUPAC name is N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine
PubChem CID145445505
Molecular FormulaC20H20F3N7
Molecular Weight415.42 g/mol
Exact Mass415.17
IUPAC NameN-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine
SMILESCc1cc(Nc2nc(-c3cccc(C(F)(F)F)n3)nc(C3CCCCN3)n2)ccn1
InChIInChI=1S/C20H20F3N7/c1-12-11-13(8-10-24-12)26-19-29-17(14-5-2-3-9-25-14)28-18(30-19)15-6-4-7-16(27-15)20(21,22)23/h4,6-8,10-11,14,25H,2-3,5,9H2,1H3,(H,24,26,28,29,30)
InChIKeyOCKHKBHTCKIMBH-UHFFFAOYSA-N
XLogP4.21
TPSA88.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.42
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-(2,2-difluoropropoxy)-N-(2-methyl-4-pyridinyl)-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine
CID 158035998
(3S,4S)-4-fluoro-1-[4-[(2-methyl-4-pyridinyl)amino]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-yl]pyrrolidin-3-ol
CID 159755143
1,1,1,3,3,3-hexadeuterio-2-[dideuterio-[[4-[(2-methyl-4-pyridinyl)amino]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-yl]amino]methyl]propan-2-ol
CID 129060702
2-N-propan-2-yl-4-N-(2-propan-2-yl-4-pyridinyl)-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 123317043
2-N-(1-methylcyclobutyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 161264106
4-N-propyl-2-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 162592292
4-N-[(1-methylcyclobutyl)methyl]-2-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 161264107
4-chloro-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine
CID 126550728
2-[1-[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-yl]propan-2-ol
CID 134197873
4-N-[2-(4-chlorophenyl)-4-pyridinyl]-2-N-propan-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 146258670
4-(2,2,3,3,3-pentafluoropropoxy)-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine
CID 134197870
2-N-(3-oxabicyclo[3.1.0]hex-1-en-6-yl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 162612753

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine?
The IUPAC name of N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine (CID 145445505) is N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine?
The canonical SMILES for N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine is Cc1cc(Nc2nc(-c3cccc(C(F)(F)F)n3)nc(C3CCCCN3)n2)ccn1.
What is the InChIKey of N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine?
The InChIKey is OCKHKBHTCKIMBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F3N7/c1-12-11-13(8-10-24-12)26-19-29-17(14-5-2-3-9-25-14)28-18(30-19)15-6-4-7-16(27-15)20(21,22)23/h4,6-8,10-11,14,25H,2-3,5,9H2,1H3,(H,24,26,28,29,30).
What are the key properties of N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine?
N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine has a molecular weight of 415.42 g/mol, XLogP of 4.21, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-pyridinyl)-4-piperidin-2-yl-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 145445505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).