N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine

C16H12N6O — CID 68526798

IUPACN-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine
SMILESc1ccc(-c2cncc(Nc3cc(-c4ccco4)[nH]n3)n2)nc1
InChIInChI=1S/C16H12N6O/c1-2-6-18-11(4-1)13-9-17-10-16(19-13)20-15-8-12(21-22-15)14-5-3-7-23-14/h1-10H,(H2,19,20,21,22)
InChIKeyGNSSAEQZQFUHPY-UHFFFAOYSA-N
MW304.31 g/mol
LogP3.27
Rot. Bonds4

About N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine

N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine (PubChem CID 68526798) has the molecular formula C16H12N6O and a molecular weight of 304.31 g/mol. Its IUPAC name is N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine.

Molecular Properties

Compound NameN-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine
PubChem CID68526798
Molecular FormulaC16H12N6O
Molecular Weight304.31 g/mol
Exact Mass304.11
IUPAC NameN-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine
SMILESc1ccc(-c2cncc(Nc3cc(-c4ccco4)[nH]n3)n2)nc1
InChIInChI=1S/C16H12N6O/c1-2-6-18-11(4-1)13-9-17-10-16(19-13)20-15-8-12(21-22-15)14-5-3-7-23-14/h1-10H,(H2,19,20,21,22)
InChIKeyGNSSAEQZQFUHPY-UHFFFAOYSA-N
XLogP3.27
TPSA92.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine?
The IUPAC name of N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine (CID 68526798) is N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine.
What is the SMILES notation for N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine?
The canonical SMILES for N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine is c1ccc(-c2cncc(Nc3cc(-c4ccco4)[nH]n3)n2)nc1.
What is the InChIKey of N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine?
The InChIKey is GNSSAEQZQFUHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N6O/c1-2-6-18-11(4-1)13-9-17-10-16(19-13)20-15-8-12(21-22-15)14-5-3-7-23-14/h1-10H,(H2,19,20,21,22).
What are the key properties of N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine?
N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine has a molecular weight of 304.31 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-6-pyridin-2-ylpyrazin-2-amine is sourced from PubChem (CID 68526798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).