N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine

C15H14N6 — CID 70689606

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine
SMILESc1cncc(-c2nccc(Nc3cc(C4CC4)[nH]n3)n2)c1
InChIInChI=1S/C15H14N6/c1-2-11(9-16-6-1)15-17-7-5-13(19-15)18-14-8-12(20-21-14)10-3-4-10/h1-2,5-10H,3-4H2,(H2,17,18,19,20,21)
InChIKeyVGGLCLRJOAFYQO-UHFFFAOYSA-N
MW278.32 g/mol
LogP2.88
Rot. Bonds4

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine (PubChem CID 70689606) has the molecular formula C15H14N6 and a molecular weight of 278.32 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine
PubChem CID70689606
Molecular FormulaC15H14N6
Molecular Weight278.32 g/mol
Exact Mass278.13
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine
SMILESc1cncc(-c2nccc(Nc3cc(C4CC4)[nH]n3)n2)c1
InChIInChI=1S/C15H14N6/c1-2-11(9-16-6-1)15-17-7-5-13(19-15)18-14-8-12(20-21-14)10-3-4-10/h1-2,5-10H,3-4H2,(H2,17,18,19,20,21)
InChIKeyVGGLCLRJOAFYQO-UHFFFAOYSA-N
XLogP2.88
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine (CID 70689606) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine is c1cncc(-c2nccc(Nc3cc(C4CC4)[nH]n3)n2)c1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine?
The InChIKey is VGGLCLRJOAFYQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6/c1-2-11(9-16-6-1)15-17-7-5-13(19-15)18-14-8-12(20-21-14)10-3-4-10/h1-2,5-10H,3-4H2,(H2,17,18,19,20,21).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine has a molecular weight of 278.32 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 70689606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).