6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine

C14H18N6 — CID 95816713

IUPAC6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine
SMILESCc1cc(Nc2cnccn2)nc([C@@H]2CCCNC2)n1
InChIInChI=1S/C14H18N6/c1-10-7-12(19-13-9-16-5-6-17-13)20-14(18-10)11-3-2-4-15-8-11/h5-7,9,11,15H,2-4,8H2,1H3,(H,17,18,19,20)/t11-/m1/s1
InChIKeyUORBETJLMLCWHN-LLVKDONJSA-N
MW270.34 g/mol
LogP1.79
Rot. Bonds3

About 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine

6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine (PubChem CID 95816713) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine
PubChem CID95816713
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine
SMILESCc1cc(Nc2cnccn2)nc([C@@H]2CCCNC2)n1
InChIInChI=1S/C14H18N6/c1-10-7-12(19-13-9-16-5-6-17-13)20-14(18-10)11-3-2-4-15-8-11/h5-7,9,11,15H,2-4,8H2,1H3,(H,17,18,19,20)/t11-/m1/s1
InChIKeyUORBETJLMLCWHN-LLVKDONJSA-N
XLogP1.79
TPSA75.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine?
The IUPAC name of 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine (CID 95816713) is 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine is Cc1cc(Nc2cnccn2)nc([C@@H]2CCCNC2)n1.
What is the InChIKey of 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine?
The InChIKey is UORBETJLMLCWHN-LLVKDONJSA-N. The full InChI is InChI=1S/C14H18N6/c1-10-7-12(19-13-9-16-5-6-17-13)20-14(18-10)11-3-2-4-15-8-11/h5-7,9,11,15H,2-4,8H2,1H3,(H,17,18,19,20)/t11-/m1/s1.
What are the key properties of 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine?
6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine has a molecular weight of 270.34 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 95816713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).