2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide

C24H17N5O — CID 166205807

IUPAC2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide
SMILESO=C(Nc1ccn(-c2ccncc2)n1)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C24H17N5O/c30-24(27-23-12-15-29(28-23)18-10-13-25-14-11-18)20-16-22(17-6-2-1-3-7-17)26-21-9-5-4-8-19(20)21/h1-16H,(H,27,28,30)
InChIKeyKEPJXZYFMIYHSC-UHFFFAOYSA-N
MW391.43 g/mol
LogP4.73
Rot. Bonds4

About 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide

2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide (PubChem CID 166205807) has the molecular formula C24H17N5O and a molecular weight of 391.43 g/mol. Its IUPAC name is 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide
PubChem CID166205807
Molecular FormulaC24H17N5O
Molecular Weight391.43 g/mol
Exact Mass391.14
IUPAC Name2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide
SMILESO=C(Nc1ccn(-c2ccncc2)n1)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C24H17N5O/c30-24(27-23-12-15-29(28-23)18-10-13-25-14-11-18)20-16-22(17-6-2-1-3-7-17)26-21-9-5-4-8-19(20)21/h1-16H,(H,27,28,30)
InChIKeyKEPJXZYFMIYHSC-UHFFFAOYSA-N
XLogP4.73
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.43
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,2-oxazol-3-yl)-2-phenylquinoline-4-carboxamide
CID 899144
N-[1-(1-phenyltriazol-4-yl)ethyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 166220183
N-(3,4-dichlorophenyl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 2339769
N-(1H-pyrazol-5-yl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 167753556
N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide
CID 2259441
2-phenyl-N-(6-pyrazol-1-yl-3-pyridinyl)quinoline-4-carboxamide
CID 55560796
2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
CID 868286
N-benzyl-2-pyridin-4-ylquinoline-4-carboxamide
CID 757748
N-(2,5-dimethylpyrazol-3-yl)-2-phenylquinoline-4-carboxamide
CID 51307625
N-(2-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39889991
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
2-pyridin-4-yl-N-(1H-1,2,4-triazol-5-yl)quinoline-4-carboxamide
CID 30865963

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide?
The IUPAC name of 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide (CID 166205807) is 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide.
What is the SMILES notation for 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide?
The canonical SMILES for 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide is O=C(Nc1ccn(-c2ccncc2)n1)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide?
The InChIKey is KEPJXZYFMIYHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17N5O/c30-24(27-23-12-15-29(28-23)18-10-13-25-14-11-18)20-16-22(17-6-2-1-3-7-17)26-21-9-5-4-8-19(20)21/h1-16H,(H,27,28,30).
What are the key properties of 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide?
2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide has a molecular weight of 391.43 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(1-pyridin-4-ylpyrazol-3-yl)quinoline-4-carboxamide is sourced from PubChem (CID 166205807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).