5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine

C15H18F2N6 — CID 70671706

IUPAC5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine
SMILESCc1nc(N)nc(N2CCC(F)(F)CC2)c1-c1ccc(N)nc1
InChIInChI=1S/C15H18F2N6/c1-9-12(10-2-3-11(18)20-8-10)13(22-14(19)21-9)23-6-4-15(16,17)5-7-23/h2-3,8H,4-7H2,1H3,(H2,18,20)(H2,19,21,22)
InChIKeyFDPFNPBGUIEIEY-UHFFFAOYSA-N
MW320.35 g/mol
LogP2.25
Rot. Bonds2

About 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine

5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine (PubChem CID 70671706) has the molecular formula C15H18F2N6 and a molecular weight of 320.35 g/mol. Its IUPAC name is 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine
PubChem CID70671706
Molecular FormulaC15H18F2N6
Molecular Weight320.35 g/mol
Exact Mass320.16
IUPAC Name5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine
SMILESCc1nc(N)nc(N2CCC(F)(F)CC2)c1-c1ccc(N)nc1
InChIInChI=1S/C15H18F2N6/c1-9-12(10-2-3-11(18)20-8-10)13(22-14(19)21-9)23-6-4-15(16,17)5-7-23/h2-3,8H,4-7H2,1H3,(H2,18,20)(H2,19,21,22)
InChIKeyFDPFNPBGUIEIEY-UHFFFAOYSA-N
XLogP2.25
TPSA93.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine with MolForge

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Related Compounds

1-[2-amino-5-(6-amino-3-pyridinyl)-6-methylpyrimidin-4-yl]piperidine-4-carboxamide
CID 70671671
1-[2-amino-5-(6-amino-3-pyridinyl)-6-methylpyrimidin-4-yl]-N-propan-2-ylpiperidine-4-carboxamide
CID 70671692
5-(6-amino-3-pyridinyl)-6-methylpyrimidine-2,4-diamine
CID 67199120
N-[1-[2-amino-5-(6-amino-3-pyridinyl)-6-methylpyrimidin-4-yl]piperidin-3-yl]acetamide
CID 70671781
5-(6-amino-3-pyridinyl)-4-ethyl-6-morpholin-4-ylpyrimidin-2-amine
CID 70671415
tert-butyl 4-[2-amino-5-(6-amino-3-pyridinyl)-6-methylpyrimidin-4-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
CID 70671675
5-bromo-2-(4,4-difluoropiperidin-1-yl)-3-methylpyrazine
CID 167713490
5-[2-(6-amino-3-pyridinyl)ethynyl]-4-methyl-6-(4-methylsulfanylpiperazin-1-yl)pyrimidin-2-amine
CID 91424311
ethyl 4-(2-amino-6-methyl-5-pyridin-3-ylpyrimidin-4-yl)piperazine-1-carboxylate
CID 70671638
5-(2,6-difluoro-3-methylphenyl)pyridin-2-amine
CID 82822652
6-(4,4-difluoropiperidin-1-yl)-5-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine
CID 177342533
N-[5-[2-amino-4-ethyl-6-(4-hydroxy-4-methylpiperidin-1-yl)pyrimidin-5-yl]-2-methyl-3-pyridinyl]methanesulfonamide
CID 71229139

Frequently Asked Questions

What is the IUPAC name of 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine?
The IUPAC name of 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine (CID 70671706) is 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine.
What is the SMILES notation for 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine?
The canonical SMILES for 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine is Cc1nc(N)nc(N2CCC(F)(F)CC2)c1-c1ccc(N)nc1.
What is the InChIKey of 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine?
The InChIKey is FDPFNPBGUIEIEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2N6/c1-9-12(10-2-3-11(18)20-8-10)13(22-14(19)21-9)23-6-4-15(16,17)5-7-23/h2-3,8H,4-7H2,1H3,(H2,18,20)(H2,19,21,22).
What are the key properties of 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine?
5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine has a molecular weight of 320.35 g/mol, XLogP of 2.25, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-amino-3-pyridinyl)-4-(4,4-difluoropiperidin-1-yl)-6-methylpyrimidin-2-amine is sourced from PubChem (CID 70671706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).