2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one

C29H22N4O2 — CID 158391528

IUPAC2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
SMILESCOc1ccc(-c2nn3c(c2-c2ccccc2)CC(C)=C(c2ccc4ncccc4c2)C3=O)cn1
InChIInChI=1S/C29H22N4O2/c1-18-15-24-27(19-7-4-3-5-8-19)28(22-11-13-25(35-2)31-17-22)32-33(24)29(34)26(18)21-10-12-23-20(16-21)9-6-14-30-23/h3-14,16-17H,15H2,1-2H3
InChIKeyGXAFBRCONSKJIE-UHFFFAOYSA-N
MW458.52 g/mol
LogP5.84
Rot. Bonds4

About 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one

2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one (PubChem CID 158391528) has the molecular formula C29H22N4O2 and a molecular weight of 458.52 g/mol. Its IUPAC name is 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one.

Molecular Properties

Compound Name2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
PubChem CID158391528
Molecular FormulaC29H22N4O2
Molecular Weight458.52 g/mol
Exact Mass458.17
IUPAC Name2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
SMILESCOc1ccc(-c2nn3c(c2-c2ccccc2)CC(C)=C(c2ccc4ncccc4c2)C3=O)cn1
InChIInChI=1S/C29H22N4O2/c1-18-15-24-27(19-7-4-3-5-8-19)28(22-11-13-25(35-2)31-17-22)32-33(24)29(34)26(18)21-10-12-23-20(16-21)9-6-14-30-23/h3-14,16-17H,15H2,1-2H3
InChIKeyGXAFBRCONSKJIE-UHFFFAOYSA-N
XLogP5.84
TPSA69.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.52
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one with MolForge

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Related Compounds

2-(3-chlorophenyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
CID 147365910
3-(cyclohexen-1-yl)-5-methyl-2-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
CID 152870167
5-methyl-2-phenyl-3-piperidin-1-yl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
CID 158881235
5-(chloromethyl)-2,3-diphenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
CID 148783799
5-(methylaminomethyl)-2,3-diphenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one
CID 153189042
7-methyl-1-phenyl-2-pyridin-4-yl-6-quinolin-6-yl-8H-indolizin-5-one
CID 165103704
methyl 2-[6-(5-methyl-7-oxo-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-6-yl)-1,3-benzothiazol-2-yl]acetate
CID 149298104
6-(2-methyl-1,3-benzothiazol-6-yl)-2,3-diphenyl-5-(pyridin-2-ylamino)-4H-pyrazolo[1,5-a]pyridin-7-one
CID 147939125
3-(3,6-dihydro-2H-pyran-4-yl)-6-(4-methoxyphenyl)-5-methyl-2-phenyl-4H-pyrazolo[1,5-a]pyridin-7-one
CID 147516700
2-chloro-4-(6-methoxy-3-pyridinyl)quinazoline
CID 134202247
3-methyl-6-phenyl-5-quinolin-6-ylpyrazin-2-amine
CID 137430865
4-(2-aminoethyl)-2,3-diphenyl-6-quinolin-6-ylpyrazolo[1,5-a]pyrimidin-7-one
CID 134347318

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one?
The IUPAC name of 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one (CID 158391528) is 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one.
What is the SMILES notation for 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one?
The canonical SMILES for 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one is COc1ccc(-c2nn3c(c2-c2ccccc2)CC(C)=C(c2ccc4ncccc4c2)C3=O)cn1.
What is the InChIKey of 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one?
The InChIKey is GXAFBRCONSKJIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22N4O2/c1-18-15-24-27(19-7-4-3-5-8-19)28(22-11-13-25(35-2)31-17-22)32-33(24)29(34)26(18)21-10-12-23-20(16-21)9-6-14-30-23/h3-14,16-17H,15H2,1-2H3.
What are the key properties of 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one?
2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one has a molecular weight of 458.52 g/mol, XLogP of 5.84, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-3-pyridinyl)-5-methyl-3-phenyl-6-quinolin-6-yl-4H-pyrazolo[1,5-a]pyridin-7-one is sourced from PubChem (CID 158391528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).