N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine

C18H26N6O — CID 75378158

IUPACN-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine
SMILESCC(C)COc1cncc(N(C)C2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C18H26N6O/c1-14(2)13-25-17-12-19-11-16(22-17)23(3)15-5-9-24(10-6-15)18-20-7-4-8-21-18/h4,7-8,11-12,14-15H,5-6,9-10,13H2,1-3H3
InChIKeyVIEWRHGHBVDYRI-UHFFFAOYSA-N
MW342.45 g/mol
LogP2.41
Rot. Bonds6

About N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine

N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine (PubChem CID 75378158) has the molecular formula C18H26N6O and a molecular weight of 342.45 g/mol. Its IUPAC name is N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine
PubChem CID75378158
Molecular FormulaC18H26N6O
Molecular Weight342.45 g/mol
Exact Mass342.22
IUPAC NameN-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine
SMILESCC(C)COc1cncc(N(C)C2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C18H26N6O/c1-14(2)13-25-17-12-19-11-16(22-17)23(3)15-5-9-24(10-6-15)18-20-7-4-8-21-18/h4,7-8,11-12,14-15H,5-6,9-10,13H2,1-3H3
InChIKeyVIEWRHGHBVDYRI-UHFFFAOYSA-N
XLogP2.41
TPSA67.27 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine?
The IUPAC name of N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine (CID 75378158) is N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine.
What is the SMILES notation for N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine?
The canonical SMILES for N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine is CC(C)COc1cncc(N(C)C2CCN(c3ncccn3)CC2)n1.
What is the InChIKey of N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine?
The InChIKey is VIEWRHGHBVDYRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O/c1-14(2)13-25-17-12-19-11-16(22-17)23(3)15-5-9-24(10-6-15)18-20-7-4-8-21-18/h4,7-8,11-12,14-15H,5-6,9-10,13H2,1-3H3.
What are the key properties of N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine?
N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine has a molecular weight of 342.45 g/mol, XLogP of 2.41, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(2-methylpropoxy)-N-(1-pyrimidin-2-ylpiperidin-4-yl)pyrazin-2-amine is sourced from PubChem (CID 75378158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).