6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine

C13H16N4 — CID 134377743

IUPAC6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine
SMILESCNc1ccc(-n2nc(C3CC3)cc2C)nc1
InChIInChI=1S/C13H16N4/c1-9-7-12(10-3-4-10)16-17(9)13-6-5-11(14-2)8-15-13/h5-8,10,14H,3-4H2,1-2H3
InChIKeyZRRYOEVEWKNVGN-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.49
Rot. Bonds3

About 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine

6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine (PubChem CID 134377743) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine
PubChem CID134377743
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine
SMILESCNc1ccc(-n2nc(C3CC3)cc2C)nc1
InChIInChI=1S/C13H16N4/c1-9-7-12(10-3-4-10)16-17(9)13-6-5-11(14-2)8-15-13/h5-8,10,14H,3-4H2,1-2H3
InChIKeyZRRYOEVEWKNVGN-UHFFFAOYSA-N
XLogP2.49
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine?
The IUPAC name of 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine (CID 134377743) is 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine.
What is the SMILES notation for 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine?
The canonical SMILES for 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine is CNc1ccc(-n2nc(C3CC3)cc2C)nc1.
What is the InChIKey of 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine?
The InChIKey is ZRRYOEVEWKNVGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-9-7-12(10-3-4-10)16-17(9)13-6-5-11(14-2)8-15-13/h5-8,10,14H,3-4H2,1-2H3.
What are the key properties of 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine?
6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine has a molecular weight of 228.30 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-cyclopropyl-5-methylpyrazol-1-yl)-N-methylpyridin-3-amine is sourced from PubChem (CID 134377743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).