3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine

C13H21N5 — CID 66016641

IUPAC3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine
SMILESCCc1nn(C)c(-n2nc(C)c(CC)c2C)c1N
InChIInChI=1S/C13H21N5/c1-6-10-8(3)15-18(9(10)4)13-12(14)11(7-2)16-17(13)5/h6-7,14H2,1-5H3
InChIKeyRXFJVIXFLQKEAE-UHFFFAOYSA-N
MW247.35 g/mol
LogP1.93
Rot. Bonds3

About 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine

3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine (PubChem CID 66016641) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine
PubChem CID66016641
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine
SMILESCCc1nn(C)c(-n2nc(C)c(CC)c2C)c1N
InChIInChI=1S/C13H21N5/c1-6-10-8(3)15-18(9(10)4)13-12(14)11(7-2)16-17(13)5/h6-7,14H2,1-5H3
InChIKeyRXFJVIXFLQKEAE-UHFFFAOYSA-N
XLogP1.93
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-3-propyl-5-(3,4,5-trimethylpyrazol-1-yl)pyrazol-4-amine
CID 66018913
ethane;4-ethyl-1,3,5-trimethylpyrazole
CID 143917345
2-(4-ethyl-3,5-dimethylpyrazol-1-yl)-6-methylpyridin-3-amine
CID 81131414
[5,6-diethyl-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridazin-4-yl]methanamine
CID 80508286
6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 80858031
5-(3,4-dimethylpyrrolidin-1-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 79188895
4,5-diethyl-2-methylpyrazol-3-amine;hydrate
CID 47000727
5-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 113335507
6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine
CID 80992252
5-(2,6-dimethylmorpholin-4-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 66013961
4-amino-3-ethyl-1-methyl-N-(1,3,5-trimethylpyrazol-4-yl)pyrazole-5-carboxamide
CID 66124158
1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)-4-methylpiperidin-4-ol
CID 81096865

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine?
The IUPAC name of 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine (CID 66016641) is 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine.
What is the SMILES notation for 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine?
The canonical SMILES for 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine is CCc1nn(C)c(-n2nc(C)c(CC)c2C)c1N.
What is the InChIKey of 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine?
The InChIKey is RXFJVIXFLQKEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-6-10-8(3)15-18(9(10)4)13-12(14)11(7-2)16-17(13)5/h6-7,14H2,1-5H3.
What are the key properties of 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine?
3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine has a molecular weight of 247.35 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 66016641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).