N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide

C24H15FN4O2 — CID 50798345

IUPACN-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide
SMILESO=C(Nc1cc(-c2cccc(F)c2)no1)c1cc(-c2ccccn2)nc2ccccc12
InChIInChI=1S/C24H15FN4O2/c25-16-7-5-6-15(12-16)21-14-23(31-29-21)28-24(30)18-13-22(20-10-3-4-11-26-20)27-19-9-2-1-8-17(18)19/h1-14H,(H,28,30)
InChIKeyOQTJWSAACIGRHP-UHFFFAOYSA-N
MW410.41 g/mol
LogP5.34
Rot. Bonds4

About N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide

N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 50798345) has the molecular formula C24H15FN4O2 and a molecular weight of 410.41 g/mol. Its IUPAC name is N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide
PubChem CID50798345
Molecular FormulaC24H15FN4O2
Molecular Weight410.41 g/mol
Exact Mass410.12
IUPAC NameN-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide
SMILESO=C(Nc1cc(-c2cccc(F)c2)no1)c1cc(-c2ccccn2)nc2ccccc12
InChIInChI=1S/C24H15FN4O2/c25-16-7-5-6-15(12-16)21-14-23(31-29-21)28-24(30)18-13-22(20-10-3-4-11-26-20)27-19-9-2-1-8-17(18)19/h1-14H,(H,28,30)
InChIKeyOQTJWSAACIGRHP-UHFFFAOYSA-N
XLogP5.34
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.41
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-difluorophenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 50798209
4-chloro-N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]thieno[3,2-c]quinoline-2-carboxamide
CID 46256188
N-(4-bromo-2-fluorophenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 39315313
7-fluoro-N-(2-methylpropyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 39349561
2,4-dimethyl-N-(3-pyridin-2-yl-1,2-oxazol-5-yl)benzamide
CID 53143120
4-chloro-N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-8-methylthieno[3,2-c]quinoline-2-carboxamide
CID 46257044
methyl 4-[(2-pyridin-2-ylquinoline-4-carbonyl)amino]benzoate
CID 2220860
N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 26636560
2-(3-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
CID 5113014
N-(5-methyl-1H-pyrazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 4793520
N-ethyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 17473754
methyl 2-(4-fluorophenoxy)-3-[(2-pyridin-2-ylquinoline-4-carbonyl)amino]propanoate
CID 166187473

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide (CID 50798345) is N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide is O=C(Nc1cc(-c2cccc(F)c2)no1)c1cc(-c2ccccn2)nc2ccccc12.
What is the InChIKey of N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is OQTJWSAACIGRHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15FN4O2/c25-16-7-5-6-15(12-16)21-14-23(31-29-21)28-24(30)18-13-22(20-10-3-4-11-26-20)27-19-9-2-1-8-17(18)19/h1-14H,(H,28,30).
What are the key properties of N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide?
N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide has a molecular weight of 410.41 g/mol, XLogP of 5.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-pyridin-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 50798345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).