4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole

C13H20N4O — CID 167941831

IUPAC4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole
SMILESCCc1c(C)nn(-c2ccn(CCOC)n2)c1C
InChIInChI=1S/C13H20N4O/c1-5-12-10(2)14-17(11(12)3)13-6-7-16(15-13)8-9-18-4/h6-7H,5,8-9H2,1-4H3
InChIKeyLZZWUWDZLYYWGU-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.89
Rot. Bonds5

About 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole

4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole (PubChem CID 167941831) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole.

Molecular Properties

Compound Name4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole
PubChem CID167941831
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole
SMILESCCc1c(C)nn(-c2ccn(CCOC)n2)c1C
InChIInChI=1S/C13H20N4O/c1-5-12-10(2)14-17(11(12)3)13-6-7-16(15-13)8-9-18-4/h6-7H,5,8-9H2,1-4H3
InChIKeyLZZWUWDZLYYWGU-UHFFFAOYSA-N
XLogP1.89
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;1-(2-methoxyethyl)-3-methylpyrazole
CID 153333995
3-[1-(2-methoxyethyl)pyrazol-3-yl]-5,6,7-trimethylpyrrolo[3,4-d]pyridazin-4-one
CID 167777670
3-(chloromethyl)-6-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridazine
CID 61256222
3-iodo-1-(2-methoxyethyl)pyrazole
CID 79788054
4-ethyl-1-(2-methoxy-3-methylphenyl)-3,5-dimethylpyrazole
CID 154383743
[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methanamine
CID 61237579
1-(4-chlorophenyl)-4-ethyl-3,5-dimethylpyrazole
CID 50888250
N-[1-(2-methoxyethyl)pyrazol-3-yl]-2-(methylamino)acetamide
CID 119767695
3-chloro-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1,2,4-triazine
CID 115001250
1-[2-(3-methoxypropoxy)ethyl]-3-methylpyrazole
CID 103184144
4-(4-ethyl-3,5-dimethylpyrazol-1-yl)benzaldehyde
CID 61238841
1-(1-ethyl-3,5-dimethylpyrazol-4-yl)-3-[1-(2-methoxyethyl)pyrazol-3-yl]urea
CID 71870343

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole?
The IUPAC name of 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole (CID 167941831) is 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole.
What is the SMILES notation for 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole?
The canonical SMILES for 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole is CCc1c(C)nn(-c2ccn(CCOC)n2)c1C.
What is the InChIKey of 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole?
The InChIKey is LZZWUWDZLYYWGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-5-12-10(2)14-17(11(12)3)13-6-7-16(15-13)8-9-18-4/h6-7H,5,8-9H2,1-4H3.
What are the key properties of 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole?
4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole has a molecular weight of 248.33 g/mol, XLogP of 1.89, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-[1-(2-methoxyethyl)pyrazol-3-yl]-3,5-dimethylpyrazole is sourced from PubChem (CID 167941831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).