2-phenylpyrazolo[3,4-c]quinolin-4-amine

C16H12N4 — CID 10491577

IUPAC2-phenylpyrazolo[3,4-c]quinolin-4-amine
SMILESNc1nc2ccccc2c2cn(-c3ccccc3)nc12
InChIInChI=1S/C16H12N4/c17-16-15-13(12-8-4-5-9-14(12)18-16)10-20(19-15)11-6-2-1-3-7-11/h1-10H,(H2,17,18)
InChIKeyMVHJGGYPZDDBQV-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.16
Rot. Bonds1

About 2-phenylpyrazolo[3,4-c]quinolin-4-amine

2-phenylpyrazolo[3,4-c]quinolin-4-amine (PubChem CID 10491577) has the molecular formula C16H12N4 and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-phenylpyrazolo[3,4-c]quinolin-4-amine.

Molecular Properties

Compound Name2-phenylpyrazolo[3,4-c]quinolin-4-amine
PubChem CID10491577
Molecular FormulaC16H12N4
Molecular Weight260.30 g/mol
Exact Mass260.11
IUPAC Name2-phenylpyrazolo[3,4-c]quinolin-4-amine
SMILESNc1nc2ccccc2c2cn(-c3ccccc3)nc12
InChIInChI=1S/C16H12N4/c17-16-15-13(12-8-4-5-9-14(12)18-16)10-20(19-15)11-6-2-1-3-7-11/h1-10H,(H2,17,18)
InChIKeyMVHJGGYPZDDBQV-UHFFFAOYSA-N
XLogP3.16
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-phenylpyrazolo[3,4-c]quinolin-4-amine?
The IUPAC name of 2-phenylpyrazolo[3,4-c]quinolin-4-amine (CID 10491577) is 2-phenylpyrazolo[3,4-c]quinolin-4-amine.
What is the SMILES notation for 2-phenylpyrazolo[3,4-c]quinolin-4-amine?
The canonical SMILES for 2-phenylpyrazolo[3,4-c]quinolin-4-amine is Nc1nc2ccccc2c2cn(-c3ccccc3)nc12.
What is the InChIKey of 2-phenylpyrazolo[3,4-c]quinolin-4-amine?
The InChIKey is MVHJGGYPZDDBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4/c17-16-15-13(12-8-4-5-9-14(12)18-16)10-20(19-15)11-6-2-1-3-7-11/h1-10H,(H2,17,18).
What are the key properties of 2-phenylpyrazolo[3,4-c]quinolin-4-amine?
2-phenylpyrazolo[3,4-c]quinolin-4-amine has a molecular weight of 260.30 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylpyrazolo[3,4-c]quinolin-4-amine is sourced from PubChem (CID 10491577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).