3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine

C13H18N4 — CID 82702145

IUPAC3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine
SMILESCCc1nn(-c2ccc(C)cn2)c(CC)c1N
InChIInChI=1S/C13H18N4/c1-4-10-13(14)11(5-2)17(16-10)12-7-6-9(3)8-15-12/h6-8H,4-5,14H2,1-3H3
InChIKeyLBTTUFWJWOBBOW-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.28
Rot. Bonds3

About 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine

3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine (PubChem CID 82702145) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine.

Molecular Properties

Compound Name3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine
PubChem CID82702145
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine
SMILESCCc1nn(-c2ccc(C)cn2)c(CC)c1N
InChIInChI=1S/C13H18N4/c1-4-10-13(14)11(5-2)17(16-10)12-7-6-9(3)8-15-12/h6-8H,4-5,14H2,1-3H3
InChIKeyLBTTUFWJWOBBOW-UHFFFAOYSA-N
XLogP2.28
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine?
The IUPAC name of 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine (CID 82702145) is 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine.
What is the SMILES notation for 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine?
The canonical SMILES for 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine is CCc1nn(-c2ccc(C)cn2)c(CC)c1N.
What is the InChIKey of 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine?
The InChIKey is LBTTUFWJWOBBOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-4-10-13(14)11(5-2)17(16-10)12-7-6-9(3)8-15-12/h6-8H,4-5,14H2,1-3H3.
What are the key properties of 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine?
3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine has a molecular weight of 230.31 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-1-(5-methyl-2-pyridinyl)pyrazol-4-amine is sourced from PubChem (CID 82702145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).