N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide

C25H17N3O — CID 25180097

IUPACN-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide
SMILESO=C(Nc1cccc2ccccc12)c1cc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C25H17N3O/c29-25(28-22-13-5-8-17-7-1-2-10-19(17)22)21-15-24(18-9-6-14-26-16-18)27-23-12-4-3-11-20(21)23/h1-16H,(H,28,29)
InChIKeyVDORHAPUWSRGAH-UHFFFAOYSA-N
MW375.43 g/mol
LogP5.70
Rot. Bonds3

About N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide

N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide (PubChem CID 25180097) has the molecular formula C25H17N3O and a molecular weight of 375.43 g/mol. Its IUPAC name is N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide
PubChem CID25180097
Molecular FormulaC25H17N3O
Molecular Weight375.43 g/mol
Exact Mass375.14
IUPAC NameN-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide
SMILESO=C(Nc1cccc2ccccc12)c1cc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C25H17N3O/c29-25(28-22-13-5-8-17-7-1-2-10-19(17)22)21-15-24(18-9-6-14-26-16-18)27-23-12-4-3-11-20(21)23/h1-16H,(H,28,29)
InChIKeyVDORHAPUWSRGAH-UHFFFAOYSA-N
XLogP5.70
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.43
LogP ≤ 55.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39889991
N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39311131
N-methyl-2-pyridin-3-ylquinoline-4-carboxamide
CID 53007972
N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 155910501
2-pyridin-3-yl-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide
CID 24538422
2-pyridin-3-yl-N-(1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide
CID 29369713
2-(3,4-dimethoxyphenyl)-N-naphthalen-1-ylquinoline-4-carboxamide
CID 3253298
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
N'-(3-phenyl-1H-pyrazole-5-carbonyl)-2-pyridin-3-ylquinoline-4-carbohydrazide
CID 27689112
2-(5-methylthiophen-2-yl)-N-naphthalen-1-ylquinoline-4-carboxamide
CID 4137703
2-pyridin-3-yl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]quinoline-4-carboxamide
CID 46668985
N-[(Z)-butan-2-ylideneamino]-2-pyridin-3-ylquinoline-4-carboxamide
CID 9078554

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide?
The IUPAC name of N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide (CID 25180097) is N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide.
What is the SMILES notation for N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide?
The canonical SMILES for N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide is O=C(Nc1cccc2ccccc12)c1cc(-c2cccnc2)nc2ccccc12.
What is the InChIKey of N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide?
The InChIKey is VDORHAPUWSRGAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17N3O/c29-25(28-22-13-5-8-17-7-1-2-10-19(17)22)21-15-24(18-9-6-14-26-16-18)27-23-12-4-3-11-20(21)23/h1-16H,(H,28,29).
What are the key properties of N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide?
N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 5.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide is sourced from PubChem (CID 25180097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).