N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide

C22H15N5O — CID 44570110

IUPACN-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nc2ccccc2c2cn(-c3ccccc3)nc12)c1cccnc1
InChIInChI=1S/C22H15N5O/c28-22(15-7-6-12-23-13-15)25-21-20-18(17-10-4-5-11-19(17)24-21)14-27(26-20)16-8-2-1-3-9-16/h1-14H,(H,24,25,28)
InChIKeyOKGSTLOYEORRHK-UHFFFAOYSA-N
MW365.40 g/mol
LogP4.22
Rot. Bonds3

About N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide

N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide (PubChem CID 44570110) has the molecular formula C22H15N5O and a molecular weight of 365.40 g/mol. Its IUPAC name is N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide
PubChem CID44570110
Molecular FormulaC22H15N5O
Molecular Weight365.40 g/mol
Exact Mass365.13
IUPAC NameN-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nc2ccccc2c2cn(-c3ccccc3)nc12)c1cccnc1
InChIInChI=1S/C22H15N5O/c28-22(15-7-6-12-23-13-15)25-21-20-18(17-10-4-5-11-19(17)24-21)14-27(26-20)16-8-2-1-3-9-16/h1-14H,(H,24,25,28)
InChIKeyOKGSTLOYEORRHK-UHFFFAOYSA-N
XLogP4.22
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.40
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide (CID 44570110) is N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide is O=C(Nc1nc2ccccc2c2cn(-c3ccccc3)nc12)c1cccnc1.
What is the InChIKey of N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide?
The InChIKey is OKGSTLOYEORRHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N5O/c28-22(15-7-6-12-23-13-15)25-21-20-18(17-10-4-5-11-19(17)24-21)14-27(26-20)16-8-2-1-3-9-16/h1-14H,(H,24,25,28).
What are the key properties of N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide?
N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide has a molecular weight of 365.40 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylpyrazolo[3,4-c]quinolin-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 44570110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).