2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine

C23H30N6O — CID 170025678

IUPAC2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine
SMILESCc1cncc(C(C)Cc2cncc(C(C)CCOc3nccc(C(C)C)n3)n2)n1
InChIInChI=1S/C23H30N6O/c1-15(2)20-6-8-26-23(29-20)30-9-7-16(3)21-13-25-12-19(28-21)10-17(4)22-14-24-11-18(5)27-22/h6,8,11-17H,7,9-10H2,1-5H3
InChIKeyAZPUPDSPCDIOAL-UHFFFAOYSA-N
MW406.53 g/mol
LogP4.41
Rot. Bonds9

About 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine

2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine (PubChem CID 170025678) has the molecular formula C23H30N6O and a molecular weight of 406.53 g/mol. Its IUPAC name is 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine.

Molecular Properties

Compound Name2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine
PubChem CID170025678
Molecular FormulaC23H30N6O
Molecular Weight406.53 g/mol
Exact Mass406.25
IUPAC Name2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine
SMILESCc1cncc(C(C)Cc2cncc(C(C)CCOc3nccc(C(C)C)n3)n2)n1
InChIInChI=1S/C23H30N6O/c1-15(2)20-6-8-26-23(29-20)30-9-7-16(3)21-13-25-12-19(28-21)10-17(4)22-14-24-11-18(5)27-22/h6,8,11-17H,7,9-10H2,1-5H3
InChIKeyAZPUPDSPCDIOAL-UHFFFAOYSA-N
XLogP4.41
TPSA86.57 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine with MolForge

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Related Compounds

2-propan-2-yl-6-[2-[4-(2-pyrimidin-4-ylpropyl)pyrimidin-2-yl]propyl]pyrazine
CID 155052483
2-methyl-5-[4-(6-propan-2-ylpyrazin-2-yl)butan-2-yl]pyrazine
CID 166909896
N,N-dimethyl-6-[1-(6-propan-2-ylpyrazin-2-yl)propan-2-yl]pyrazin-2-amine
CID 167090245
4-propan-2-yl-2-(2,2,2-trifluoroethoxy)pyrimidine
CID 90379560
4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine
CID 146214625
2-methyl-6-(3-methylbutyl)pyrazine
CID 572730
2-pentan-2-yl-6-propan-2-ylpyrazine
CID 137452291
2-methyl-2-[4-propan-2-yl-6-[2-(4-propan-2-ylpyrimidin-2-yl)oxyethoxymethyl]pyrimidin-2-yl]oxypropane-1,3-diol
CID 134461855
1-(4-propan-2-ylpyrimidin-2-yl)propan-2-amine
CID 63318928
2-[1-[2,6-di(propan-2-yl)-4-pyridinyl]propan-2-yl]-6-propan-2-ylpyrazine
CID 138605605
2-cyclobutyloxy-4-propan-2-ylpyrimidine
CID 58592746
ethane;2-ethyl-4-propan-2-ylpyrimidine
CID 154681512

Frequently Asked Questions

What is the IUPAC name of 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine?
The IUPAC name of 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine (CID 170025678) is 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine.
What is the SMILES notation for 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine?
The canonical SMILES for 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine is Cc1cncc(C(C)Cc2cncc(C(C)CCOc3nccc(C(C)C)n3)n2)n1.
What is the InChIKey of 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine?
The InChIKey is AZPUPDSPCDIOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N6O/c1-15(2)20-6-8-26-23(29-20)30-9-7-16(3)21-13-25-12-19(28-21)10-17(4)22-14-24-11-18(5)27-22/h6,8,11-17H,7,9-10H2,1-5H3.
What are the key properties of 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine?
2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine has a molecular weight of 406.53 g/mol, XLogP of 4.41, 9 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(6-methylpyrazin-2-yl)propyl]-6-[4-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-yl]pyrazine is sourced from PubChem (CID 170025678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).