4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine

C14H20N4 — CID 82700133

IUPAC4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine
SMILESCCCc1cc(-n2nc(CC)cc2CC)ncn1
InChIInChI=1S/C14H20N4/c1-4-7-12-9-14(16-10-15-12)18-13(6-3)8-11(5-2)17-18/h8-10H,4-7H2,1-3H3
InChIKeyOYMDHPAXODIQIN-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.74
Rot. Bonds5

About 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine

4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine (PubChem CID 82700133) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine.

Molecular Properties

Compound Name4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine
PubChem CID82700133
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine
SMILESCCCc1cc(-n2nc(CC)cc2CC)ncn1
InChIInChI=1S/C14H20N4/c1-4-7-12-9-14(16-10-15-12)18-13(6-3)8-11(5-2)17-18/h8-10H,4-7H2,1-3H3
InChIKeyOYMDHPAXODIQIN-UHFFFAOYSA-N
XLogP2.74
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(3,5-diethylpyrazol-1-yl)-4-pyridinyl]methyl]propan-1-amine
CID 82694623
N-[[5-(3,5-diethylpyrazol-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 107381268
3-methyl-1-(6-propylpyrimidin-4-yl)pyrrolidin-3-ol
CID 103357775
1-[5-chloro-2-(3,5-diethylpyrazol-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 114927493
6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine
CID 82698482
6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine
CID 82699860
barium(2+);bis(tris(3,5-diethylpyrazol-1-yl)boranuide)
CID 139141227
3,5-diethyl-1-propylpyrazole
CID 82699697
[6-(3,5-diethylpyrazol-1-yl)-2-pyridinyl]methanamine
CID 82693564
1-(6-methylpyrimidin-4-yl)-3-propylpyrazole-5-sulfonyl chloride
CID 55210622
4-(3,5-diethylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 82699253
4-(3,5-diethylpyrazol-1-yl)pyridine
CID 82700412

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine?
The IUPAC name of 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine (CID 82700133) is 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine.
What is the SMILES notation for 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine?
The canonical SMILES for 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine is CCCc1cc(-n2nc(CC)cc2CC)ncn1.
What is the InChIKey of 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine?
The InChIKey is OYMDHPAXODIQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-4-7-12-9-14(16-10-15-12)18-13(6-3)8-11(5-2)17-18/h8-10H,4-7H2,1-3H3.
What are the key properties of 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine?
4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine has a molecular weight of 244.34 g/mol, XLogP of 2.74, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine is sourced from PubChem (CID 82700133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).