4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine

C15H15N5O — CID 133487295

IUPAC4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine
SMILESCCc1cc(Oc2cnn(C)c2)nc(-c2ccccn2)n1
InChIInChI=1S/C15H15N5O/c1-3-11-8-14(21-12-9-17-20(2)10-12)19-15(18-11)13-6-4-5-7-16-13/h4-10H,3H2,1-2H3
InChIKeyKGMKBLGRKICAQQ-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.63
Rot. Bonds4

About 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine

4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine (PubChem CID 133487295) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine.

Molecular Properties

Compound Name4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine
PubChem CID133487295
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine
SMILESCCc1cc(Oc2cnn(C)c2)nc(-c2ccccn2)n1
InChIInChI=1S/C15H15N5O/c1-3-11-8-14(21-12-9-17-20(2)10-12)19-15(18-11)13-6-4-5-7-16-13/h4-10H,3H2,1-2H3
InChIKeyKGMKBLGRKICAQQ-UHFFFAOYSA-N
XLogP2.63
TPSA65.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine?
The IUPAC name of 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine (CID 133487295) is 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine.
What is the SMILES notation for 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine?
The canonical SMILES for 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine is CCc1cc(Oc2cnn(C)c2)nc(-c2ccccn2)n1.
What is the InChIKey of 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine?
The InChIKey is KGMKBLGRKICAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-3-11-8-14(21-12-9-17-20(2)10-12)19-15(18-11)13-6-4-5-7-16-13/h4-10H,3H2,1-2H3.
What are the key properties of 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine?
4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine has a molecular weight of 281.32 g/mol, XLogP of 2.63, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-(1-methylpyrazol-4-yl)oxy-2-pyridin-2-ylpyrimidine is sourced from PubChem (CID 133487295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).