N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine

C19H20N6 — CID 56768481

IUPACN-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine
SMILESc1cncc(-c2nc(NC3CCCNC3)cc(-c3ccncc3)n2)c1
InChIInChI=1S/C19H20N6/c1-3-15(12-21-7-1)19-24-17(14-5-9-20-10-6-14)11-18(25-19)23-16-4-2-8-22-13-16/h1,3,5-7,9-12,16,22H,2,4,8,13H2,(H,23,24,25)
InChIKeyQYIOSYDCXAYQMI-UHFFFAOYSA-N
MW332.41 g/mol
LogP2.76
Rot. Bonds4

About N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine

N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine (PubChem CID 56768481) has the molecular formula C19H20N6 and a molecular weight of 332.41 g/mol. Its IUPAC name is N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine
PubChem CID56768481
Molecular FormulaC19H20N6
Molecular Weight332.41 g/mol
Exact Mass332.17
IUPAC NameN-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine
SMILESc1cncc(-c2nc(NC3CCCNC3)cc(-c3ccncc3)n2)c1
InChIInChI=1S/C19H20N6/c1-3-15(12-21-7-1)19-24-17(14-5-9-20-10-6-14)11-18(25-19)23-16-4-2-8-22-13-16/h1,3,5-7,9-12,16,22H,2,4,8,13H2,(H,23,24,25)
InChIKeyQYIOSYDCXAYQMI-UHFFFAOYSA-N
XLogP2.76
TPSA75.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine?
The IUPAC name of N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine (CID 56768481) is N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine is c1cncc(-c2nc(NC3CCCNC3)cc(-c3ccncc3)n2)c1.
What is the InChIKey of N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine?
The InChIKey is QYIOSYDCXAYQMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6/c1-3-15(12-21-7-1)19-24-17(14-5-9-20-10-6-14)11-18(25-19)23-16-4-2-8-22-13-16/h1,3,5-7,9-12,16,22H,2,4,8,13H2,(H,23,24,25).
What are the key properties of N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine?
N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 332.41 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-2-pyridin-3-yl-6-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 56768481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).