2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine

C15H21N5 — CID 50951797

IUPAC2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine
SMILESCCCc1cnc(C)nc1NC(C)Cc1cnccn1
InChIInChI=1S/C15H21N5/c1-4-5-13-9-18-12(3)20-15(13)19-11(2)8-14-10-16-6-7-17-14/h6-7,9-11H,4-5,8H2,1-3H3,(H,18,19,20)
InChIKeyKGGYMWHRWHGSJQ-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.57
Rot. Bonds6

About 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine

2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine (PubChem CID 50951797) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine
PubChem CID50951797
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine
SMILESCCCc1cnc(C)nc1NC(C)Cc1cnccn1
InChIInChI=1S/C15H21N5/c1-4-5-13-9-18-12(3)20-15(13)19-11(2)8-14-10-16-6-7-17-14/h6-7,9-11H,4-5,8H2,1-3H3,(H,18,19,20)
InChIKeyKGGYMWHRWHGSJQ-UHFFFAOYSA-N
XLogP2.57
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
The IUPAC name of 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine (CID 50951797) is 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine is CCCc1cnc(C)nc1NC(C)Cc1cnccn1.
What is the InChIKey of 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
The InChIKey is KGGYMWHRWHGSJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-4-5-13-9-18-12(3)20-15(13)19-11(2)8-14-10-16-6-7-17-14/h6-7,9-11H,4-5,8H2,1-3H3,(H,18,19,20).
What are the key properties of 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine?
2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 50951797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).