4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine

C10H13N3 — CID 59283459

IUPAC4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine
SMILESCC(C)C1=CC=NC2=CNC=CN21
InChIInChI=1S/C10H13N3/c1-8(2)9-3-4-12-10-7-11-5-6-13(9)10/h3-8,11H,1-2H3
InChIKeyDRCXMSKSPGCLBQ-UHFFFAOYSA-N
MW175.24 g/mol
LogP1.79
Rot. Bonds1

About 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine

4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine (PubChem CID 59283459) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine.

Molecular Properties

Compound Name4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine
PubChem CID59283459
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC Name4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine
SMILESCC(C)C1=CC=NC2=CNC=CN21
InChIInChI=1S/C10H13N3/c1-8(2)9-3-4-12-10-7-11-5-6-13(9)10/h3-8,11H,1-2H3
InChIKeyDRCXMSKSPGCLBQ-UHFFFAOYSA-N
XLogP1.79
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine?
The IUPAC name of 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine (CID 59283459) is 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine.
What is the SMILES notation for 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine?
The canonical SMILES for 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine is CC(C)C1=CC=NC2=CNC=CN21.
What is the InChIKey of 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine?
The InChIKey is DRCXMSKSPGCLBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-8(2)9-3-4-12-10-7-11-5-6-13(9)10/h3-8,11H,1-2H3.
What are the key properties of 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine?
4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine has a molecular weight of 175.24 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-8H-pyrazino[1,2-a]pyrimidine is sourced from PubChem (CID 59283459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).