N-ethyl-5-pyrazol-1-ylpyridin-3-amine

C10H12N4 — CID 104535894

IUPACN-ethyl-5-pyrazol-1-ylpyridin-3-amine
SMILESCCNc1cncc(-n2cccn2)c1
InChIInChI=1S/C10H12N4/c1-2-12-9-6-10(8-11-7-9)14-5-3-4-13-14/h3-8,12H,2H2,1H3
InChIKeyDMTUAUQFASMWRE-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.70
Rot. Bonds3

About N-ethyl-5-pyrazol-1-ylpyridin-3-amine

N-ethyl-5-pyrazol-1-ylpyridin-3-amine (PubChem CID 104535894) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is N-ethyl-5-pyrazol-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-5-pyrazol-1-ylpyridin-3-amine
PubChem CID104535894
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC NameN-ethyl-5-pyrazol-1-ylpyridin-3-amine
SMILESCCNc1cncc(-n2cccn2)c1
InChIInChI=1S/C10H12N4/c1-2-12-9-6-10(8-11-7-9)14-5-3-4-13-14/h3-8,12H,2H2,1H3
InChIKeyDMTUAUQFASMWRE-UHFFFAOYSA-N
XLogP1.70
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-pyrazol-1-ylpyridin-3-amine?
The IUPAC name of N-ethyl-5-pyrazol-1-ylpyridin-3-amine (CID 104535894) is N-ethyl-5-pyrazol-1-ylpyridin-3-amine.
What is the SMILES notation for N-ethyl-5-pyrazol-1-ylpyridin-3-amine?
The canonical SMILES for N-ethyl-5-pyrazol-1-ylpyridin-3-amine is CCNc1cncc(-n2cccn2)c1.
What is the InChIKey of N-ethyl-5-pyrazol-1-ylpyridin-3-amine?
The InChIKey is DMTUAUQFASMWRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-2-12-9-6-10(8-11-7-9)14-5-3-4-13-14/h3-8,12H,2H2,1H3.
What are the key properties of N-ethyl-5-pyrazol-1-ylpyridin-3-amine?
N-ethyl-5-pyrazol-1-ylpyridin-3-amine has a molecular weight of 188.23 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-pyrazol-1-ylpyridin-3-amine is sourced from PubChem (CID 104535894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).