6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine

C14H20N4 — CID 82699860

IUPAC6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(-n2nc(CC)cc2CC)n1
InChIInChI=1S/C14H20N4/c1-4-11-10-12(5-2)18(17-11)14-9-7-8-13(16-14)15-6-3/h7-10H,4-6H2,1-3H3,(H,15,16)
InChIKeyDMVSMXKHFMHSER-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.82
Rot. Bonds5

About 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine

6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine (PubChem CID 82699860) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine
PubChem CID82699860
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(-n2nc(CC)cc2CC)n1
InChIInChI=1S/C14H20N4/c1-4-11-10-12(5-2)18(17-11)14-9-7-8-13(16-14)15-6-3/h7-10H,4-6H2,1-3H3,(H,15,16)
InChIKeyDMVSMXKHFMHSER-UHFFFAOYSA-N
XLogP2.82
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine?
The IUPAC name of 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine (CID 82699860) is 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine?
The canonical SMILES for 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine is CCNc1cccc(-n2nc(CC)cc2CC)n1.
What is the InChIKey of 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine?
The InChIKey is DMVSMXKHFMHSER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-4-11-10-12(5-2)18(17-11)14-9-7-8-13(16-14)15-6-3/h7-10H,4-6H2,1-3H3,(H,15,16).
What are the key properties of 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine?
6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine has a molecular weight of 244.34 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine is sourced from PubChem (CID 82699860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).