4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine

C9H13F2N5 — CID 171825010

IUPAC4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine
SMILESCc1nc(N)nc(N2CCC(F)(F)CC2)n1
InChIInChI=1S/C9H13F2N5/c1-6-13-7(12)15-8(14-6)16-4-2-9(10,11)3-5-16/h2-5H2,1H3,(H2,12,13,14,15)
InChIKeyYTJIVFFOTBJZNB-UHFFFAOYSA-N
MW229.23 g/mol
LogP1.00
Rot. Bonds1

About 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine

4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine (PubChem CID 171825010) has the molecular formula C9H13F2N5 and a molecular weight of 229.23 g/mol. Its IUPAC name is 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine
PubChem CID171825010
Molecular FormulaC9H13F2N5
Molecular Weight229.23 g/mol
Exact Mass229.11
IUPAC Name4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine
SMILESCc1nc(N)nc(N2CCC(F)(F)CC2)n1
InChIInChI=1S/C9H13F2N5/c1-6-13-7(12)15-8(14-6)16-4-2-9(10,11)3-5-16/h2-5H2,1H3,(H2,12,13,14,15)
InChIKeyYTJIVFFOTBJZNB-UHFFFAOYSA-N
XLogP1.00
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine with MolForge

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Related Compounds

s-Triazine, 2-amino-4-((4-methyl-1-piperazinyl)methyl)-6-piperidino-
CID 207511
4-(4-Methylpiperazin-1-yl)-6-propyl-1,3,5-triazin-2-amine
CID 63868328
s-Triazine, 2,4-dipiperidino-6-methyl-
CID 33386
1,3,5-Triazin-2-amine, 4-methyl-6-(1-piperidinyl)-
CID 207476
Triazine, 2-amino-4-isopropyl-6-piperidino-
CID 207477
1,3,5-Triazin-2-amine, 4-(4-methyl-1-piperazinyl)-6-(trifluoromethyl)-
CID 3041955
1,3,5-Triazin-2-amine, N-cyclohexyl-4-methyl-6-(trifluoromethyl)-
CID 3041969
4-(1,1,2,2,3,3,3-Heptafluoropropyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 164682313
4-Amino-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile
CID 5302615
2-Methylsulfanyl-4-piperidin-1-yl-6-(trifluoromethyl)-1,3,5-triazine
CID 21605224
6-[[3-(Trifluoromethyl)piperidin-1-yl]methyl]-1,3,5-triazine-2,4-diamine
CID 17563829
2-N,2-N-dimethyl-6-propan-2-yl-4-N-[(3S)-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-1,3,5-triazine-2,4-diamine
CID 171358992

Frequently Asked Questions

What is the IUPAC name of 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine (CID 171825010) is 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine is Cc1nc(N)nc(N2CCC(F)(F)CC2)n1.
What is the InChIKey of 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is YTJIVFFOTBJZNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F2N5/c1-6-13-7(12)15-8(14-6)16-4-2-9(10,11)3-5-16/h2-5H2,1H3,(H2,12,13,14,15).
What are the key properties of 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine?
4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 229.23 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,4-difluoropiperidin-1-yl)-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 171825010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).