4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine

C11H14N4O — CID 791107

IUPAC4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine
SMILESCCOc1cc(-n2nc(C)cc2C)ncn1
InChIInChI=1S/C11H14N4O/c1-4-16-11-6-10(12-7-13-11)15-9(3)5-8(2)14-15/h5-7H,4H2,1-3H3
InChIKeyUDQDNZVWIZHCCY-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.68
Rot. Bonds3

About 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine

4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine (PubChem CID 791107) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine.

Molecular Properties

Compound Name4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine
PubChem CID791107
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine
SMILESCCOc1cc(-n2nc(C)cc2C)ncn1
InChIInChI=1S/C11H14N4O/c1-4-16-11-6-10(12-7-13-11)15-9(3)5-8(2)14-15/h5-7H,4H2,1-3H3
InChIKeyUDQDNZVWIZHCCY-UHFFFAOYSA-N
XLogP1.68
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(5-Methylpyrazol-1-yl)ethoxy]-6-piperidin-1-ylpyrimidine
CID 166634775
4-[3-(5-Methylpyrazol-1-yl)propoxy]-6-piperidin-1-ylpyrimidine
CID 166635102
Dulcerozine
CID 87753
N-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-6-methoxy-N-methylpyrimidin-4-amine
CID 50980960
4-(4-Chloro-5-methyl-3-trifluoromethyl-1H-pyrazol-1-yl)-6-(prop-2-ynyloxy)pyrimidine
CID 90745637
2-(3,5-Dimethylpyrazol-1-yl)-4-methoxy-6-methylpyrimidine
CID 3458206
2-(5-methoxy-3-methyl-1H-pyrazol-1-yl)-4,6-dimethylpyrimidine
CID 12771928
4-ethoxy-2-(1-propyl-1H-pyrazol-5-yl)pyrimidine
CID 121511647
N-(4,4-difluorocyclohexyl)-2-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidin-4-amine
CID 132207718
4-[3-(Trifluoromethyl)-5-methyl-1H-pyrazole-1-yl]-6-(3-butynyloxy)pyrimidine
CID 102132806
4-[3-(Trifluoromethyl)-5-methyl-1H-pyrazole-1-yl]-6-(2-propynyloxy)pyrimidine
CID 102132807
4-But-3-yn-2-yloxy-6-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine
CID 102132808

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine?
The IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine (CID 791107) is 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine.
What is the SMILES notation for 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine?
The canonical SMILES for 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine is CCOc1cc(-n2nc(C)cc2C)ncn1.
What is the InChIKey of 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine?
The InChIKey is UDQDNZVWIZHCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-4-16-11-6-10(12-7-13-11)15-9(3)5-8(2)14-15/h5-7H,4H2,1-3H3.
What are the key properties of 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine?
4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine has a molecular weight of 218.26 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpyrazol-1-yl)-6-ethoxypyrimidine is sourced from PubChem (CID 791107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).